CHEBI:5955 - Ipomoeamarone

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Ipomoeamarone
ChEBI ID CHEBI:5955
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formulae C15H22O3
C15H22O3
Net Charge 0
Average Mass 250.334
Monoisotopic Mass 250.15689
InChI InChI=1S/C15H22O3/c1-11(2)8-13(16)9-15(3)6-4-14(18-15)12-5-7-17-10-12/h5,7,10-11,14H,4,6,8-9H2,1-3H3/t14-,15+/m1/s1
InChIKey WOFDWNOSFDVCDF-CABCVRRESA-N
SMILES [C@@H]1(C=2C=COC2)O[C@@](CC(CC(C)C)=O)(C)CC1
ChEBI Ontology
Outgoing Ipomoeamarone (CHEBI:5955) is a oxolanes (CHEBI:26912)
Synonyms Sources
(+)-Ngaione KEGG COMPOUND
Ipomoeamarone KEGG COMPOUND
Manual Xrefs Databases
C00003152 KNApSAcK
C09689 KEGG COMPOUND
View more database links
Registry Number Type Source
494-23-5 CAS Registry Number KEGG COMPOUND
Last Modified
10 July 2017