input word = C00014564

Metabolite InformationStructural formula
Name Sanggenol M
Formula C45H46O11
Mw 762.30401231
CAS RN 205174-33-0
C_ID C00014564 ,
InChIKey VENYMAZORMHPCP-OOUVFDGINA-N
InChICode InChI=1S/C45H46O11/c1-22(2)6-5-7-24-16-31(27-12-9-25(46)18-34(27)49)40(44(54)30-14-15-33(48)29(43(30)53)11-8-23(3)4)32(17-24)41-36(51)21-39-42(45(41)55)37(52)20-38(56-39)28-13-10-26(47)19-35(28)50/h6,8-10,12-15,17-19,21,31-32,38,40,46-51,53,55H,5,7,11,16,20H2,1-4H3/t31-,32-,38+,40-/m1/s1
SMILES CC(C)=CCCC1=C[C@@H](c2c(O)cc3c(c2O)C(=O)C[C@@H](c2ccc(O)cc2O)O3)[C@H](C(=O)c2ccc(O)c(CC=C(C)C)c2O)[C@@H](c2ccc(O)cc2O)C1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMoraceaeMorus mongolica Ref.
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