C_ID |
CAS ID |
Metabolite |
Molecular formula |
Mw | Organism |
C00000149 | 6750-60-3 | Espatulenol | C15H24O | 220.18271539 | Citrus aurantium |
C00000153 | 29803-81-4 | cis-p-Menth-2-en-1-ol | C10H18O | 154.1357652 | Citrus aurantium |
C00000154 | 29803-82-5 | trans-p-Menth-2-en-1-ol | C10H18O | 154.1357652 | Citrus aurantium |
C00000184 | 2867-05-2 | alpha-Thujene | C10H16 | 136.12520051 | Citrus aurantium |
C00000300 | 523-59-1 | Seselin | C14H12O3 | 228.07864425 | Citrus aurantium |
C00000357 | 66-25-1 | Hexanal | C6H12O | 100.08881501 | Citrus aurantium |
C00000674 | 491-70-3 | 5,7,3',4'-Tetrahydroxyflavone | C15H10O6 | 286.04773805 | Citrus aurantium |
C00000805 | 80-56-8 | alpha-Pinene | C10H16 | 136.12520051 | Citrus aurantium |
C00000816 | 127-91-3 | beta-Pinene | C10H16 | 136.12520051 | Citrus aurantium |
C00000823 | 138-86-3 | Limonene | C10H16 | 136.12520051 | Citrus aurantium |
C00000830 | 15537-55-0 | cis-Sabinene hydrate | C10H18O | 154.1357652 | Citrus aurantium |
C00000839 | 13466-78-9 | 3-Carene | C10H16 | 136.12520051 | Citrus aurantium |
C00000843 | 3338-55-4 | cis-beta-Ocimene | C10H16 | 136.12520051 | Citrus aurantium |
C00000844 | 106-22-9 | Citronellol | C10H20O | 156.15141526 | Citrus aurantium var.amara |
C00000845 | 106-24-1 | (E)-geraniol | C10H18O | 154.1357652 | Citrus aurantium |
C00000853 | 123-35-3 | beta-Myrcene | C10H16 | 136.12520051 | Citrus aurantium |
C00000855 | 106-25-2 | beta-Nerol | C10H18O | 154.1357652 | Citrus aurantium var.amara |
C00000861 | 586-62-9 | alpha-Terpinolene | C10H16 | 136.12520051 | Citrus aurantium |
C00000862 | 3779-61-1 | trans-beta-Ocimene | C10H16 | 136.12520051 | Citrus aurantium |
C00000931 | 144-68-3 | Zeaxanthin | C40H56O2 | 568.42803103 | Citrus aurantium |
C00000960 | 552-58-9 | Eriodictyol | C15H12O6 | 288.06338812 | Citrus aurantium |
C00000968 | 520-33-2 | Hesperetin | C16H14O6 | 302.07903818 | Citrus aurantium L. var. amara |
C00000970 | 520-26-3 | Hesperidin | C28H34O15 | 610.18977042 | Citrus aurantium L. var. amara |
C00000982 | 480-41-1 | Naringenin | C15H12O5 | 272.06847349 | Citrus aurantium L. var. amara |
C00000983 | 10236-47-2 | Naringin | C27H32O14 | 580.17920573 | Citrus aurantium |
C00000984 | 14259-46-2 | Narirutin | C27H32O14 | 580.17920573 | Citrus aurantium L. var. amara |
C00000986 | 13241-32-2 | Neoeriocitrin | C27H32O15 | 596.17412036 | Citrus aurantium L. var. amara |
C00000987 | 13241-33-3 | Neohesperidin | C28H34O15 | 610.18977042 | Citrus aurantium |
C00000995 | 14941-08-3 | Poncirin | C28H34O14 | 594.1948558 | Citrus aurantium |
C00000998 | 529-55-5 | Naringenin 7-O-beta-D-glucoside | C21H22O10 | 434.12129692 | Citrus aurantium |
C00001036 | 520-34-3 | Diosmetin | C16H12O6 | 300.06338812 | Citrus aurantium |
C00001076 | 478-01-3 | Nobiletin | C21H22O8 | 402.13146768 | Citrus aurantium |
C00001105 | 481-53-8 | Tangeretin | C20H20O7 | 372.12090299 | Citrus aurantium |
C00001313 | 488-10-8 | (Z)-Jasmone | C11H16O | 164.12011513 | Citrus aurantium |
C00001417 | 539-15-1 | Hordenine | C10H15NO | 165.11536411 | Citrus aurantium |
C00001418 | 120-72-9 | Indole | C8H7N | 117.05784923 | Citrus aurantium |
C00001425 | 104-14-3 | Octopamine | C8H11NO2 | 153.0789786 | Citrus aurantium L. var. amara |
C00001435 | 51-67-2 | Tyramine | C8H11NO | 137.08406398 | Citrus aurantium L. var. amara |
C00002663 | 60-12-8 | 2-Phenylethanol | C8H10O | 122.07316494 | Citrus aurantium |
C00002780 | 501-13-3 | Feruloylputrescine | C14H20N2O3 | 264.14739252 | Citrus aurantium |
C00003029 | 79-92-5 | Camphene | C10H16 | 136.12520051 | Citrus aurantium |
C00003035 | 141-27-5 | trans-Citral | C10H16O | 152.12011513 | Citrus aurantium |
C00003036 | 106-26-3 | cis-Citral | C10H16O | 152.12011513 | Citrus aurantium |
C00003040 | 99-87-6 | p-Cymene | C10H14 | 134.10955045 | Citrus aurantium |
C00003043 | 7705-14-8 | Dipentene | C10H16 | 136.12520051 | Citrus aurantium var. bergamia |
C00003046 | 105-87-3 | Geranyl acetate | C12H20O2 | 196.14632988 | Citrus aurantium |
C00003047 | 78-70-6 | (+-)-Linalool | C10H18O | 154.1357652 | Citrus aurantium |
C00003048 | 115-95-7 | Linalyl acetate | C12H20O2 | 196.14632988 | Citrus aurantium ssp.bergamia |
C00003048 | 115-95-7 | Linalyl acetate | C12H20O2 | 196.14632988 | Citrus aurantium var.amara |
C00003051 | 99-83-2 | alpha-Phellandrene | C10H16 | 136.12520051 | Citrus aurantium |
C00003060 | 99-86-5 | alpha-Terpinene | C10H16 | 136.12520051 | Citrus aurantium |
C00003061 | 99-85-4 | gamma-Terpinene | C10H16 | 136.12520051 | Citrus aurantium |
C00003110 | 87-44-5 | beta-Caryophyllene | C15H24 | 204.18780077 | Citrus aurantium |
C00003118 | 3856-25-5 | alpha-Copaene | C15H24 | 204.18780077 | Citrus aurantium |
C00003130 | 502-61-4 | alpha-Farnesene | C15H24 | 204.18780077 | Citrus aurantium |
C00003131 | 18794-84-8 | E-beta-farnesene | C15H24 | 204.18780077 | Citrus aurantium |
C00003147 | 6753-98-6 | alpha-Caryophyllene (obsol.) | C15H24 | 204.18780077 | Citrus aurantium |
C00003166 | 142-50-7 | Nerolidol | C15H26O | 222.19836545 | Citrus aurantium |
C00003467 | 150-86-7 | Phytol | C20H40O | 296.3079159 | Citrus aurantium |
C00003719 | 1180-71-8 | Limonin | C26H30O8 | 470.19406794 | Citrus aurantium |
C00003817 | 520-36-5 | Apigenin | C15H10O5 | 270.05282343 | Citrus aurantium |
C00003821 | 5631-70-9 | 5,7,4'-Trimethoxyflavone | C18H16O5 | 312.09977362 | Citrus aurantium |
C00003841 | 1168-42-9 | Scutellarein 5,6,7,4'-tetramethyl ether | C19H18O6 | 342.11033831 | Citrus aurantium |
C00003912 | 17290-70-9 | Isosinensetin | C20H20O7 | 372.12090299 | Citrus aurantium |
C00003936 | 2174-59-6 | 5-Demethylnobiletin | C20H20O8 | 388.11581762 | Citrus aurantium |
C00004157 | 17306-46-6 | Rhoifolin | C27H30O14 | 578.16355567 | Citrus aurantium |
C00004167 | 31498-83-6 | Apigenin 7-neohesperidoside-4'-glucoside | C33H40O19 | 740.2163791 | Citrus aurantium |
C00004283 | 25694-72-8 | Lonicerin | C27H30O15 | 594.15847029 | Citrus aurantium |
C00004508 | 38665-01-9 | Diosmetin 7-neohesperidoside | C28H32O15 | 608.17412036 | Citrus aurantium |
C00004631 | 117-39-5 | Quercetin | C15H10O7 | 302.04265268 | Citrus aurantium |
C00004657 | 522-16-7 | Auranetin | C20H20O7 | 372.12090299 | Citrus aurantium |
C00004673 | 50439-46-8 | 5-Hydroxyauranetin | C20H20O8 | 388.11581762 | Citrus aurantium |
C00006229 | 23666-13-9 | Vicenin | C27H30O15 | 594.15847029 | Citrus aurantium |
C00006231 | 29428-58-8 | Lucenin 2 | C27H30O16 | 610.15338491 | Citrus aurantium |
C00006284 | 98813-28-6 | 6,8-Di-C-glucopyranosyldiosmetin | C28H32O16 | 624.16903498 | Citrus aurantium |
C00007242 | 495-61-4 | beta-Bisabolene | C15H24 | 204.18780077 | Citrus aurantium |
C00007453 | 33880-83-0 | beta-Elemene | C15H24 | 204.18780077 | Citrus aurantium |
C00007636 | 483-76-1 | delta-Cadinene | C15H24 | 204.18780077 | Citrus aurantium |
C00008295 | 13463-28-0 | Eriocitrin | C27H32O15 | 596.17412036 | Citrus aurantium |
C00008297 | 2500-68-7 | Hesperetin 7-O-glucoside | C22H24O11 | 464.13186161 | Citrus aurantium |
C00008386 | 17257-22-6 | Narirutin 4'-glucoside | C33H42O19 | 742.23202916 | Citrus aurantium |
C00010301 | 126-90-9 | (+)-S-Linalool | C10H18O | 154.1357652 | Citrus aurantium ssp.bergamia |
C00010301 | 126-90-9 | (+)-S-Linalool | C10H18O | 154.1357652 | Citrus aurantium var.amara |
C00010325 | 14049-11-7 | Epoxylinalool | C10H18O2 | 170.13067982 | Citrus aurantium |
C00010872 | 555-10-2 | beta-Phellandrene | C10H16 | 136.12520051 | Citrus aurantium |
C00010875 | 586-63-0 | 2,4(8)-p-Menthadiene | C10H16 | 136.12520051 | Citrus aurantium |
C00010905 | 1195-32-0 | 4-Isopropenyl-1-methylbenzene | C10H12 | 132.09390038 | Citrus aurantium |
C00010974 | 527-84-4 | alpha-Cymene | C10H14 | 134.10955045 | Citrus aurantium |
C00011067 | 508-32-7 | Teresantanane | C10H16 | 136.12520051 | Citrus aurantium |
C00012011 | 20307-84-0 | delta-Elemene | C15H24 | 204.18780077 | Citrus aurantium |
C00012425 | 24703-35-3 | (+)-Bicyclogermacrene | C15H24 | 204.18780077 | Citrus aurantium |
C00013304 | 6601-66-7 | 4',5,7,8-Tetramethoxyflavone | C19H18O6 | 342.11033831 | Citrus aurantium |
C00013596 | 2306-27-6 | Sinensetin | C20H20O7 | 372.12090299 | Citrus aurantium |
C00019560 | 64-17-5 | Ethanol | C2H6O | 46.04186481 | Citrus aurantium |
C00021903 | 13474-59-4 | trans-alpha-Bergamotene | C15H24 | 204.18780077 | Citrus aurantium |
C00026478 | 91-22-5 | Quinoline | C9H7N | 129.05784923 | Citrus aurantium |
C00027432 | 370-98-9 | N-Methyltyramine | C9H13NO | 151.09971404 | Citrus aurantium |
C00029335 | 13877-91-3 | (E)-beta-Ocimene | C10H16 | 136.12520051 | Citrus aurantium |
C00029339 | 40716-66-3 | (6E)-3,7,11-Trimethyl-1,6,10-dodecatrien-3-ol | C15H26O | 222.19836545 | Citrus aurantium |
C00029350 | 28973-97-9 | cis-beta-Farnesene | C15H24 | 204.18780077 | Citrus aurantium |
C00029479 | 93-07-2 | 3,4-dimethoxybenzoic acid | C9H10O4 | 182.05790881 | Citrus aurantium |
C00029536 | 100-09-4 | 4-Methoxybenzoic acid | C8H8O3 | 152.04734412 | Citrus aurantium |
C00029544 | 562-74-3 | 4-Terpineol | C10H18O | 154.1357652 | Citrus aurantium |
C00029674 | 98-55-5 | alpha-Terpineol | C10H18O | 154.1357652 | Citrus aurantium |
C00029763 | 495-02-3 | Aurapten | C19H22O3 | 298.15689457 | Citrus aurantium |
C00030099 | 112-31-2 | Decanal | C10H20O | 156.15141526 | Citrus aurantium |
C00030828 | 124-19-6 | Nonadienal | C9H18O | 142.1357652 | Citrus aurantium |
C00030880 | 124-13-0 | Octanal | C8H16O | 128.12011513 | Citrus aurantium |
C00031258 | 3387-41-5 | 4(10)-Thujene | C10H16 | 136.12520051 | Citrus aurantium |
C00034452 | 100-52-7 | Benzaldehyde | C7H6O | 106.04186481 | Citrus aurantium |
C00034600 | 134-20-3 | Methyl anthranilate | C8H9NO2 | 151.06332854 | Citrus aurantium |
C00034775 | 110-93-0 | 6-Methyl-5-hepten-2-one | C8H14O | 126.10446507 | Citrus aurantium |
C00034989 | 27400-72-2 | (E)-Ocimene | C10H16 | 136.12520051 | Citrus aurantium |
C00035043 | 80-26-2 | alpha-terpineol acetate | C12H20O2 | 196.14632988 | Citrus aurantium |
C00035092 | 106-28-5 | trans-Farnesol | C15H26O | 222.19836545 | Citrus aurantium |
C00035130 | 1189-09-9 | Methyl geranate | C11H18O2 | 182.13067982 | Citrus aurantium |
C00035138 | 141-12-8 | Neryl acetate | C12H20O2 | 196.14632988 | Citrus aurantium |
C00035823 | 106-23-0 | Citronellal | C10H18O | 154.1357652 | Citrus aurantium |
C00036308 | 28028-64-0 | D-germacrene | C15H24 | 204.18780077 | Citrus aurantium |
C00046607 | 644-30-4 | alpha-Curcumene | C15H22 | 202.1721507 | Citrus aurantium |
C00047768 | 1162664-57-4 | Brutieridin | C34H42O19 | 754.23202916 | Citrus aurantium |
C00047991 | 1162664-58-5 | Melitidin | C33H40O18 | 724.22146448 | Citrus aurantium |
C00048263 | 90973-78-7 | 2,6-Dimethyl-1,3,5,7-octatetraene | C10H14 | 134.10955045 | Citrus aurantium |
C00048304 | 67-64-1 | Acetone | C3H6O | 58.04186481 | Citrus aurantium |
C00048310 | 673-84-7 | 2,6-Dimethyl-2,4,6-octatriene | C10H16 | 136.12520051 | Citrus aurantium |
C00048315 | 1686-30-2 | alpha-Myrcene | C10H16 | 136.12520051 | Citrus aurantium |
C00048326 | 14029-4 | Benzene acetonitrile | C8H7N | 117.05784923 | Citrus aurantium |
C00048350 | 97-42-7 | Carvyl acetate | C12H18O2 | 194.13067982 | Citrus aurantium |
C00048438 | 67-63-0 | Isopropyl alcohol | C3H8O | 60.05751488 | Citrus aurantium |
C00048486 | 7216-56-0 | Neo-allo-ocimene | C10H16 | 136.12520051 | Citrus aurantium |
C00048498 | 103-70-8 | n-Phenylformamide | C7H7NO | 121.05276385 | Citrus aurantium |
C00051735 | 94-07-5 | Synephrine | C9H13NO2 | 167.09462867 | Citrus aurantium L. var. amara |
C00052868 | 140-29-4 | Benzeneacetonitrile | C8H7N | 117.05784923 | Citrus aurantium |
C00053039 | 206978-14-5 | Epoxybergamottin | C21H22O5 | 354.14672381 | Citrus aurantium |
C00053122 | 6874-36-8 | cis-ocimene | C10H18 | 138.14085057 | Citrus aurantium |
C00053828 | 78-69-3 | Tetrahydrolinalool | C10H22O | 158.16706532 | Citrus aurantium |
C00053869 | 71353-61-2 | 1-Tritriacontanol | C33H68O | 480.52701679 | Citrus aurantium |
C00054941 | 425408-71-5 | Citrusin V | C27H46N6O7 | 566.34279787 | Citrus aurantium |
C00054942 | 425408-72-6 | Citrusin VI | C41H62N8O8 | 794.46906102 | Citrus aurantium |
C00056187 | 1134-95-8 | trans-Carvyl acetate | C12H18O2 | 194.13067982 | Citrus aurantium |
C00056389 | 1044818-57-6 | Ichanexic acid | C26H32O11 | 520.19446187 | Citrus aurantium |
C00059951 | 144-39-8 | Linalyl propionate | C13H22O2 | 210.16197995 | Citrus aurantium |
C00062142 | 542-78-9 | Malonaldehyde | C3H4O2 | 72.02112937 | Citrus aurantium |
C00063136 | 85-91-6 | Methyl 2-(methylamino)benzoate | C9H11NO2 | 165.0789786 | Citrus aurantium |