CHEBI:2497 - Adynerin

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ChEBI Name Adynerin
ChEBI ID CHEBI:2497
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C30H44O7
Net Charge 0
Average Mass 516.667
Monoisotopic Mass 516.30870
InChI InChI=1S/C30H44O7/c1-17-26(32)22(33-4)15-25(35-17)36-20-6-9-27(2)19(14-20)5-11-29-23(27)8-10-28(3)21(7-12-30(28,29)37-29)18-13-24(31)34-16-18/h13,17,19-23,25-26,32H,5-12,14-16H2,1-4H3/t17-,19-,20+,21-,22-,23-,25+,26+,27+,28-,29+,30-/m1/s1
InChIKey BYZQVAOKDQTHHP-QFUJVLJYSA-N
SMILES CO[C@@H]1C[C@H](O[C@H]2CC[C@@]3(C)[C@H](CC[C@@]45O[C@@]44CC[C@H](C6=CC(=O)OC6)[C@@]4(C)CC[C@H]35)C2)O[C@H](C)[C@@H]1O
Roles Classification
Application(s): cardioprotective agent
Any protective agent that is able to prevent damage to the heart.
(via cardiac glycoside )
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ChEBI Ontology
Outgoing Adynerin (CHEBI:2497) is a cardenolide glycoside (CHEBI:38092)
Synonyms Sources
Adynerigenin 3-O-beta-D-diginoside KEGG COMPOUND
Adynerin KEGG COMPOUND
Manual Xrefs Databases
C00003600 KNApSAcK
C08845 KEGG COMPOUND
View more database links
Registry Number Type Source
35109-93-4 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014