CHEBI:3863 - Convallamarogenin

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ChEBI Name Convallamarogenin
ChEBI ID CHEBI:3863
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C27H42O4
Net Charge 0
Average Mass 430.621
Monoisotopic Mass 430.30831
InChI InChI=1S/C27H42O4/c1-15-7-10-27(30-14-15)16(2)24-22(31-27)13-21-19-6-5-17-11-18(28)12-23(29)26(17,4)20(19)8-9-25(21,24)3/h16-24,28-29H,1,5-14H2,2-4H3/t16-,17+,18+,19+,20-,21-,22-,23+,24-,25-,26-,27+/m0/s1
InChIKey XLHFBXMTUNORSV-ZENYHQJXSA-N
SMILES C[C@H]1[C@H]2[C@H](C[C@H]3[C@@H]4CC[C@@H]5C[C@@H](O)C[C@@H](O)[C@]5(C)[C@H]4CC[C@]23C)O[C@]11CCC(=C)CO1
ChEBI Ontology
Outgoing Convallamarogenin (CHEBI:3863) is a triterpenoid (CHEBI:36615)
Synonym Source
Convallamarogenin KEGG COMPOUND
Manual Xrefs Databases
C00003568 KNApSAcK
C08891 KEGG COMPOUND
View more database links
Registry Number Type Source
16683-27-5 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014