input word = C00064082

Metabolite InformationStructural formula
Name Concinnoside A
Formula C41H64O13
Mw 764.43469213
CAS RN 190275-52-6
C_ID C00064082
InChIKey YMNUAVJTBGUEFW-ULLOZDIZSA-N
InChICode InChI=1S/C41H64O13/c1-36(2)14-20-19-8-9-24-38(5)12-11-26(53-34-32(48)30(46)29(45)22(52-34)18-51-33-31(47)28(44)21(42)17-50-33)37(3,4)23(38)10-13-39(24,6)40(19,7)15-25(43)41(20)16-27(36)54-35(41)49/h8,20-34,42-48H,9-18H2,1-7H3/t20-,21-,22+,23-,24+,25+,26-,27-,28-,29+,30-,31+,32+,33-,34-,38-,39+,40+,41+/m0/s1
SMILES CC1(C)CC2C3=CCC4C5(C)CCC(OC6OC(COC7OCC(O)C(O)C7O)C(O)C(O)C6O)C(C)(C)C5CCC4(C)C3(C)CC(O)C23CC1OC3=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeAlbizia mollis Ref.
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