C_ID |
CAS ID |
Metabolite |
Molecular formula |
Mw | Organism |
C00000823 | 138-86-3 | Limonene | C10H16 | 136.12520051 | Durio zibethinus |
C00001180 | 107-92-6 | Butanoic acid | C4H8O2 | 88.0524295 | Durio zibethinus |
C00001208 | 109-52-4 | pentanoic acid | C5H10O2 | 102.06807956 | Durio zibethinus |
C00001218 | 142-62-1 | Caproic acid | C6H12O2 | 116.08372963 | Durio zibethinus |
C00001224 | 60-33-3 | Linoleic acid | C18H32O2 | 280.24023027 | Durio zibethinus |
C00001258 | 74-93-1 | Methyl mercaptan | CH4S | 48.00337086 | Durio zibethinus |
C00001267 | 107-03-9 | Propane-1-thiol | C3H8S | 76.03467099 | Durio zibethinus |
C00001308 | 141-78-6 | Ethyl acetate | C4H8O2 | 88.0524295 | Durio zibethinus |
C00003047 | 78-70-6 | (+-)-Linalool | C10H18O | 154.1357652 | Durio zibethinus |
C00007247 | 463-40-1 | alpha-Linolenic acid | C18H30O2 | 278.2245802 | Durio zibethinus |
C00007266 | 7783-06-4 | Hydrogen sulfide | H2S | 33.98772079 | Durio zibethinus |
C00007392 | 75-07-0 | Acetaldehyde | C2H4O | 44.02621475 | Durio zibethinus |
C00019558 | 116-09-6 | Acetol | C3H6O2 | 74.03677944 | Durio zibethinus |
C00019875 | 525-21-3 | Fraxidin | C11H10O5 | 222.05282343 | Durio zibethinus |
C00029422 | 112-92-5 | 1-Octadecanol | C18H38O | 270.29226583 | Durio zibethinus |
C00030220 | 7452-79-1 | Ethyl-2-methylbutanoate | C7H14O2 | 130.09937969 | Durio zibethinus |
C00031089 | 2150-43-8 | Methyl protocatechuate | C8H8O4 | 168.04225874 | Durio zibethinus |
C00031413 | 344944-09-8 | threo-Carolignan E | C40H42O13 | 730.26254143 | Durio zibethinus |
C00031634 | 57296-22-7 | Boehmenan | C40H40O12 | 712.25197674 | Durio zibethinus |
C00032373 | 70287-70-6 | trans-4-Hydroxymellein | C10H10O4 | 194.05790881 | Durio zibethinus |
C00035612 | 123-66-0 | Ethyl hexanoate | C8H16O2 | 144.11502975 | Durio zibethinus |
C00035613 | 106-32-1 | Ethyl octanoate | C10H20O2 | 172.14632988 | Durio zibethinus |
C00035614 | 103-36-6 | Ethyl cinnamate | C11H12O2 | 176.08372963 | Durio zibethinus |
C00035617 | 105-37-3 | Ethyl propanoate | C5H10O2 | 102.06807956 | Durio zibethinus |
C00041517 | 72021-22-8 | Eucryphin | C15H16O9 | 340.07943211 | Durio zibethinus |
C00050420 | 28664-35-9 | 4,5-Dimethyl-3-hydroxy-2(5H)-furanone | C6H8O3 | 128.04734412 | Durio zibethinus |
C00050424 | 513-86-0 | 3-hydroxy-2-Butanone | C4H8O2 | 88.0524295 | Durio zibethinus |
C00050438 | 110-81-6 | Diethyl disulfide | C4H10S2 | 122.02239178 | Durio zibethinus |
C00050442 | 75-08-1 | Ethanethiol | C2H6S | 62.01902092 | Durio zibethinus |
C00050446 | 105-54-4 | Ethyl butanoate | C6H12O2 | 116.08372963 | Durio zibethinus |
C00050455 | 628-97-7 | Ethyl palmitate | C18H36O2 | 284.27153039 | Durio zibethinus |
C00050470 | 78-83-1 | 2-methyl-1-propanol | C4H10O | 74.07316494 | Durio zibethinus |
C00052216 | 95-16-9 | Benzothiazole | C7H5NS | 135.0142699 | Durio zibethinus |
C00052497 | 1730-91-2 | (2S)-2-methylbutanoic acid | C5H10O2 | 102.06807956 | Durio zibethinus |
C00052572 | 36653-82-4 | 1-Hexadecanol | C16H34O | 242.26096571 | Durio zibethinus |
C00052644 | 24683-00-9 | 2-Methoxy-3-isobutylpyrazine | C9H14N2O | 166.11061308 | Durio zibethinus |
C00052697 | 31030-39-4 | 3-Sulfanylbutan-1-ol | C4H10OS | 106.04523567 | Durio zibethinus |
C00052712 | 3658-77-3 | 4-Hydroxy-2,5-dimethyl-3(2H)-furanone | C6H8O3 | 128.04734412 | Durio zibethinus |
C00052888 | 10307-61-6 | Ethyl (2S)-2-methylbutanoate | C7H14O2 | 130.09937969 | Durio zibethinus |
C00053032 | 2021-28-5 | Ethyl 3-phenylpropanoate | C11H14O2 | 178.09937969 | Durio zibethinus |
C00053048 | 2396-84-1 | Ethyl (2E,4E)-hexa-2,4-dienoate | C8H12O2 | 140.08372963 | Durio zibethinus |
C00053067 | 3600-24-6 | diethyl trisulfide | C4H10S3 | 153.99446251 | Durio zibethinus |
C00053123 | 69382-62-3 | ehtane-1, 1-dithiol | C2H6S2 | 93.99109165 | Durio zibethinus |
C00053169 | 97-62-1 | Ethyl isobutyrate | C6H12O2 | 116.08372963 | Durio zibethinus |
C00053479 | 10307-60-5 | Methyl (2S)-2-methylbutanoate | C6H12O2 | 116.08372963 | Durio zibethinus |
C00053485 | 868-57-5 | Methyl 2-methylbutanoate | C6H12O2 | 116.08372963 | Durio zibethinus |
C00053705 | 151409-47-1 | Propyl (2S)-2-methylbutanoate | C8H16O2 | 144.11502975 | Durio zibethinus |
C00053842 | 134454-31-2 | trans-4,5-epoxy-(2E)-dec-2-enal | C10H16O2 | 168.11502975 | Durio zibethinus |
C00054010 | 4253-89-8 | Bis(1-methylethyl) disulfide | C6H14S2 | 150.05369191 | Durio zibethinus |
C00055803 | 6028-61-1 | Dipropyl trisulfide | C6H14S3 | 182.02576264 | Durio zibethinus |
C00057171 | 183554-17-8 | 4-Methyl-2,3,5-trithiaheptane | C5H12S3 | 168.01011257 | Durio zibethinus |
C00057390 | 43040-01-3 | 3-Methyl-1,2,4-trithiane | C4H8S3 | 151.97881245 | Durio zibethinus |
C00057684 | 94944-48-6 | 5-Methyl-3,4,6-trithiaoctane | C6H14S3 | 182.02576264 | Durio zibethinus |
C00057982 | 183554-12-3 | 2,4,5-Trithiaheptane | C4H10S3 | 153.99446251 | Durio zibethinus |
C00057983 | 183554-16-7 | 3,4,6-Trithiaoctane | C5H12S3 | 168.01011257 | Durio zibethinus |
C00059617 | 130932-26-2 | (+)-(R)-O-Desmethyllasiodiplodin | C16H22O4 | 278.15180919 | Durio zibethinus |
C00059863 | 1407182-53-9 | 1-[[1-(Methylthio)ethyl]thio]-ethanethiol | C5H12S3 | 168.01011257 | Durio zibethinus |
C00059864 | 1407182-54-0 | 1-[[1-(Ethylthio)ethyl]thio]-ethanethiol | C6H14S3 | 182.02576264 | Durio zibethinus |
C00059865 | 1407182-55-1 | (2E)-3-[(2R,3R)-3-Pentyl-2-oxiranyl]-2-propenal | C10H16O2 | 168.11502975 | Durio zibethinus |
C00059904 | 14252-42-7 | 1,1-Bis(ethylsulfanyl)ethane | C6H14S2 | 150.05369191 | Durio zibethinus |
C00060135 | 15679-13-7 | 2-Isopropyl-4-methylthiazole | C7H11NS | 141.06122009 | Durio zibethinus |
C00060273 | 16630-66-3 | Methyl 2-methylthioacetate | C4H8O2S | 120.02450023 | Durio zibethinus |
C00060483 | 181356-00-3 | Mercaptopropanol | C3H8OS | 92.02958561 | Durio zibethinus |
C00060484 | 181356-01-4 | S-(1-Methylethyl) 3-(methylthio)-2-butenethioate | C8H14OS2 | 190.04860653 | Durio zibethinus |
C00060485 | 181356-02-5 | 4-Mercapto-5-methyl-2-hexanone | C7H14OS | 146.0765358 | Durio zibethinus |
C00060700 | 20333-39-5 | Ethyl methyl disulfide | C3H8S2 | 108.00674172 | Durio zibethinus |
C00060758 | 20807-99-2 | Ethyl thiobutyrate | C6H12OS | 132.06088574 | Durio zibethinus |
C00060992 | 23654-92-4 | 3,5-Dimethyl 1,2,4-trithiolane | C4H8S3 | 151.97881245 | Durio zibethinus |
C00061031 | 2432-77-1 | s-Methyl thiohexanoate | C7H14OS | 146.0765358 | Durio zibethinus |
C00061032 | 2432-83-9 | s-Methyl thiooctanoate | C9H18OS | 174.10783593 | Durio zibethinus |
C00061211 | 27538-10-9 | 2-Ethyl-4-hydroxy-5-methyl-3(2H)-furanone | C7H10O3 | 142.06299419 | Durio zibethinus |
C00061233 | 28040-00-8 | Heptadecenoic acid | C17H32O2 | 268.24023027 | Durio zibethinus |
C00061383 | 31331-53-0 | 1-(Methylthio)ethanethiol | C3H8S2 | 108.00674172 | Durio zibethinus |
C00061384 | 31331-54-1 | Acetaldehyde ethyldithiohemiacetal | C4H10S2 | 122.02239178 | Durio zibethinus |
C00061385 | 31331-55-2 | 1-(Methylthio)-1-propanethiol | C4H10S2 | 122.02239178 | Durio zibethinus |
C00061386 | 31331-56-3 | 1-Ethylsulfanyl-propane-1-thiol | C5H12S2 | 136.03804184 | Durio zibethinus |
C00061633 | 37064-20-3 | Propyl 2-methylbutanoate | C8H16O2 | 144.11502975 | Durio zibethinus |
C00061809 | 4455-13-4 | Ethyl (methylthio)acetate | C5H10O2S | 134.04015029 | Durio zibethinus |
C00061896 | 478555-48-5 | (2R)-2-Hydroxy-2-methyl-butanoic acid, ethyl ester | C7H14O3 | 146.09429431 | Durio zibethinus |
C00062073 | 5287-45-6 | 3-Methylbut-2-ene-1-thiol | C5H10S | 102.05032105 | Durio zibethinus |
C00062190 | 554-12-1 | Methyl propanoate | C4H8O2 | 88.0524295 | Durio zibethinus |
C00062202 | 557-00-6 | Propyl 3-methylbutanoate | C8H16O2 | 144.11502975 | Durio zibethinus |
C00062245 | 5704-20-1 | 2-Hydroxy-3-pentanone | C5H10O2 | 102.06807956 | Durio zibethinus |
C00062356 | 593-47-5 | 9-Octadecen-1-ol | C18H36O | 268.27661577 | Durio zibethinus |
C00062475 | 6221-96-1 | Hexadecyl propionate | C19H38O2 | 298.28718046 | Durio zibethinus |
C00062495 | 625-60-5 | S-Ethyl thioacetate | C4H8OS | 104.02958561 | Durio zibethinus |
C00062650 | 67-71-0 | Dimethyl sulfone | C2H6O2S | 94.00885017 | Durio zibethinus |
C00062844 | 7379-30-8 | 1,1-Bis(methylthio)ethane | C4H10S2 | 122.02239178 | Durio zibethinus |
C00062930 | 76229-82-8 | 3-Methyl-2,4-dithiahexane | C5H12S2 | 136.03804184 | Durio zibethinus |
C00063195 | 860210-40-8 | 1-(Propylthio)ethanethiol | C5H12S2 | 136.03804184 | Durio zibethinus |
C00063267 | 878652-88-1 | cis-2-Butene-1-thiol | C4H8S | 88.03467099 | Durio zibethinus |
C00063522 | 96504-25-5 | 4,6-Dimethyl-1,2,3,5-tetrathietane | C4H8S4 | 183.95088318 | Durio zibethinus |