CHEBI:6077 - Ivalin

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Ivalin
ChEBI ID CHEBI:6077
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C15H20O3
Net Charge 0
Average Mass 248.318
Monoisotopic Mass 248.14124
InChI InChI=1S/C15H20O3/c1-8-4-10(16)6-15(3)7-13-11(5-12(8)15)9(2)14(17)18-13/h10-13,16H,1-2,4-7H2,3H3/t10-,11+,12-,13+,15+/m0/s1
InChIKey OVIILQQKQPCQTF-GGAZOKNXSA-N
SMILES C[C@@]12C[C@H]3OC(=O)C(=C)[C@H]3C[C@H]1C(=C)C[C@H](O)C2
ChEBI Ontology
Outgoing Ivalin (CHEBI:6077) is a eudesmane sesquiterpenoid (CHEBI:62508)
Synonym Source
Ivalin KEGG COMPOUND
Manual Xrefs Databases
C00003310 KNApSAcK
C09488 KEGG COMPOUND
View more database links
Registry Number Type Source
5938-03-4 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014