input word = C00008932

Metabolite InformationStructural formula
Name Gambiriin B1
Formula C30H26O11
Mw 562.14751167
CAS RN 76250-47-0
C_ID C00008932 ,
InChIKey HLOYODWMNGTCGH-CYJQFKNVNA-N
InChICode InChI=1S/C30H26O11/c31-14-7-19(34)15(20(35)8-14)10-25-27(12-1-3-17(32)22(37)5-12)28-26(40-25)11-21(36)16-9-24(39)29(41-30(16)28)13-2-4-18(33)23(38)6-13/h1-8,11,24-25,27,29,31-39H,9-10H2/t24-,25+,27+,29+/m0/s1
SMILES Oc1cc(O)c(C[C@H]2Oc3cc(O)c4c(c3[C@@H]2c2ccc(O)c(O)c2)O[C@H](c2ccc(O)c(O)c2)[C@@H](O)C4)c(O)c1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRubiaceaeUncaria gambir Ref.
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