input word = C00041306

Metabolite InformationStructural formula
Name Acanthopanaxoside C
(-)-Acanthopanaxoside C
Formula C41H64O13
Mw 764.43469213
CAS RN 915792-04-0
C_ID C00041306 ,
InChIKey GBMCCWVDXLJPRP-QLKNAOLMNA-N
InChICode InChI=1S/C41H64O13/c1-20-27(43)29(45)30(46)32(52-20)54-31-28(44)23(42)19-51-33(31)53-26-11-12-38(5)24(36(26,2)3)10-13-40(7)25(38)9-8-21-22-18-37(4,34(47)48)14-16-41(22,35(49)50)17-15-39(21,40)6/h8,20,22-33,42-46H,9-19H2,1-7H3,(H,47,48)(H,49,50)/t20-,22-,23-,24-,25+,26-,27-,28-,29+,30+,31+,32-,33-,37+,38-,39+,40+,41-/m0/s1
SMILES [C@]1(CC[C@]2([C@@H](C1)C1=CC[C@H]3[C@]([C@@]1(CC2)C)(CC[C@@H]1[C@@]3(CC[C@@H](C1(C)C)O[C@@H]1OC[C@@H]([C@@H]([C@H]1O[C@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)C)O)O)O)O)O)C)C)C(=O)O)(C)C(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAraliaceaeAcanthopanax senticosus Ref.
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