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CHEBI:81158 - Corotoxigenin-3-O-alpha-L-rhamnopyranoside

ChEBI IDCHEBI:81158
ChEBI NameCorotoxigenin-3-O-alpha-L-rhamnopyranoside
Stars
Last Modified17 March 2016
DownloadsMolfile
FormulaC29H42O9
Net Charge0
Average Mass534.646
Monoisotopic Mass534.28288
SMILES[H][C@@]12CC[C@]3([H])[C@]([H])(CC[C@]4(C)[C@@H](C5=CC(=O)OC5)CC[C@]34O)[C@@]1(C=O)CC[C@H](O[C@@H]1O[C@@H](C)[C@H](O)[C@@H](O)[C@H]1O)C2
InChIInChI=1S/C29H42O9/c1-15-23(32)24(33)25(34)26(37-15)38-18-5-9-28(14-30)17(12-18)3-4-21-20(28)6-8-27(2)19(7-10-29(21,27)35)16-11-22(31)36-13-16/h11,14-15,17-21,23-26,32-35H,3-10,12-13H2,1-2H3/t15-,17-,18-,19+,20-,21+,23-,24+,25+,26-,27+,28+,29-/m0/s1
InChIKeyQITDIWRKOXBKAM-GXMITZSZSA-N
Roles Classification
Application:
cardioprotective agent  Any protective agent that is able to prevent damage to the heart.
ChEBI Ontology
Outgoing Relation(s)
Corotoxigenin-3-O-alpha-L-rhamnopyranoside (CHEBI:81158) is a cardenolide glycoside (CHEBI:38092)
Corotoxigenin-3-O-alpha-L-rhamnopyranoside (CHEBI:81158) is a steroid aldehyde (CHEBI:131565)
Manual XrefsDatabases
C17525KEGG COMPOUND
Registry NumbersSources
CAS:58917-39-8KEGG COMPOUND