CHEBI:231080 - Pseudojujubogenin

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Pseudojujubogenin
ChEBI ID CHEBI:231080
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C30H48O4
Net Charge 0
Average Mass 472.710
Monoisotopic Mass 472.35526
InChI InChI=1S/C30H48O4/c1-18(2)14-19-15-33-30-16-29(17-34-30)20(24(30)28(19,7)32)8-9-22-26(5)12-11-23(31)25(3,4)21(26)10-13-27(22,29)6/h14,19-24,31-32H,8-13,15-17H2,1-7H3
InChIKey XXMXKZMQNIHTRQ-UHFFFAOYSA-N
SMILES O1C23OCC(C(O)(C3C4C(C5(C(C6(C(CC5)C(C(O)CC6)(C)C)C)CC4)C)(C2)C1)C)C=C(C)C
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Found in feces (BTO:0000440). See: MetaboLights Study
ChEBI Ontology
Outgoing Pseudojujubogenin (CHEBI:231080) is a triterpenoid (CHEBI:36615)
IUPAC Name
2,6,6,10,16-pentamethyl-17-(2-methylprop-1-enyl)-19,21-dioxahexacyclo[18.2.1.01,14.02,11.05,10.015,20]tricosane-7,16-diol
Manual Xref Database
HMDB0256893 HMDB
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