input word = C00008928

Metabolite InformationStructural formula
Name Gambiriin A1
Formula C30H28O12
Mw 580.15807636
CAS RN 76250-49-2
C_ID C00008928 ,
InChIKey AAOPKIFUFWCDQZ-SMEVCGONNA-N
InChICode InChI=1S/C30H28O12/c31-14-7-19(34)15(20(35)8-14)9-24(39)27(12-1-3-17(32)22(37)5-12)28-25(40)11-21(36)16-10-26(41)29(42-30(16)28)13-2-4-18(33)23(38)6-13/h1-8,11,24,26-27,29,31-41H,9-10H2/t24-,26-,27+,29+/m0/s1
SMILES c1(c2c(c(c(c1)O)[C@@H]([C@H](Cc1c(cc(cc1O)O)O)O)c1ccc(c(c1)O)O)O[C@@H]([C@H](C2)O)c1cc(c(cc1)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRosaceaeSanguisorba officinalis Ref.
PlantaeRubiaceaeUncaria gambir Ref.
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