CHEBI:7029 - Musaroside

ChEBI IDCHEBI:7029
ChEBI NameMusaroside
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC30H44O10
Net Charge0
Average Mass564.672
Monoisotopic Mass564.29345
SMILES[H][C@]12CC[C@@]3([H])[C@@]4(O)CC[C@]([H])(C5=CC(=O)OC5)[C@@]4(C)[C@H](O)C(=O)[C@]3([H])[C@@]1(C)CC[C@H](O[C@@H]1O[C@H](C)[C@H](O)[C@H](OC)[C@H]1O)C2
InChIInChI=1S/C30H44O10/c1-14-22(32)25(37-4)24(34)27(39-14)40-17-7-9-28(2)16(12-17)5-6-19-21(28)23(33)26(35)29(3)18(8-10-30(19,29)36)15-11-20(31)38-13-15/h11,14,16-19,21-22,24-27,32,34-36H,5-10,12-13H2,1-4H3/t14-,16-,17+,18-,19-,21-,22+,24-,25+,26-,27+,28+,29+,30+/m1/s1
InChIKeyTYVPUZUDLFQZOP-CROJTKMBSA-N
Roles Classification
Application:
cardioprotective agent  Any protective agent that is able to prevent damage to the heart.
ChEBI Ontology
Outgoing Relation(s)
Musaroside (CHEBI:7029) is a cardenolide glycoside (CHEBI:38092)
Synonyms  Source
MusarosideKEGG COMPOUND
Sarmutogenin 3-O-beta-D-digitalosideKEGG COMPOUND
Manual XrefsDatabases
C00003631KNApSAcK
C08875KEGG COMPOUND
Registry NumbersSources
CAS:465-97-4KEGG COMPOUND