input word = C00006224

Metabolite InformationStructural formula
Name Saponarin
Formula C27H30O15
Mw 594.15847029
CAS RN 20310-89-8
C_ID C00006224 ,
InChIKey HGUVPEBGCAVWID-ALWFZJRANA-N
InChICode InChI=1S/C27H30O15/c28-7-15-19(32)22(35)24(37)26(40-15)18-14(41-27-25(38)23(36)20(33)16(8-29)42-27)6-13-17(21(18)34)11(31)5-12(39-13)9-1-3-10(30)4-2-9/h1-6,15-16,19-20,22-30,32-38H,7-8H2/t15-,16-,19-,20-,22+,23+,24-,25-,26+,27-/m1/s1
SMILES c1(c(c(c2c(c1)oc(cc2=O)c1ccc(cc1)O)O)[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCaryophyllaceaeSaponaria officinalis Ref.
PlantaeCucurbitaceaeBryonia dioica Ref.
PlantaeCucurbitaceaeCucumis sativus Ref.
PlantaeFabaceaeLespedeza juncea Ref.
PlantaeGentianaceaeGentiana algida Ref.
PlantaeGentianaceaeGentiana decumbens Ref.
PlantaeGentianaceaeGentiana decumbers Ref.
PlantaeGentianaceaeGentiana macrophylla Ref.
PlantaeGentianaceaeGentiana piasezkii Ref.
PlantaeGentianaceaeGentiana triflora Ref.
PlantaeMalvaceaeHibiscus syriacus Ref.
PlantaePassifloraceaePassiflora incarnata Ref.
PlantaePoaceaeArrhenatherum sp. Ref.
--Mnium cuspidatum Ref.
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