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CHEBI:81174 - Akeboside Std

Default Structure
ChEBI IDCHEBI:81174
ChEBI NameAkeboside Std
Stars
DownloadsMolfile
FormulaC41H66O13
Net Charge0
Average Mass766.966
Monoisotopic Mass766.45034
SMILES[H][C@]12CC=C3[C@]4([H])CC(C)(C)CC[C@]4(C(=O)O)CC[C@@]3(C)[C@]1(C)CC[C@]1([H])[C@]2(C)CC[C@H](O[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@]1(C)CO
InChIInChI=1S/C41H66O13/c1-36(2)13-15-41(35(49)50)16-14-39(5)21(22(41)17-36)7-8-26-37(3)11-10-27(38(4,20-43)25(37)9-12-40(26,39)6)53-34-32(28(45)23(44)19-51-34)54-33-31(48)30(47)29(46)24(18-42)52-33/h7,22-34,42-48H,8-20H2,1-6H3,(H,49,50)/t22-,23-,24+,25+,26+,27-,28-,29+,30-,31+,32+,33-,34-,37-,38-,39+,40+,41-/m0/s1
InChIKeyRROGHRHLBLVQSG-UUWFFIQNSA-N
ChEBI Ontology
Outgoing Relation(s)
Akeboside Std (CHEBI:81174) is a triterpenoid (CHEBI:36615)
Synonyms  Source
Akebia saponin CKEGG COMPOUND
Cauloside CKEGG COMPOUND
Manual XrefsDatabases
C17547KEGG COMPOUND