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CHEBI:181504 - 4-[5-(7-hydroxy-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-3-methylpentoxy]-4-oxobutanoic acid

Default Structure
ChEBI IDCHEBI:181504
ChEBI Name4-[5-(7-hydroxy-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-3-methylpentoxy]-4-oxobutanoic acid
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SubmitterMetaboLights
DownloadsMolfile
FormulaC24H40O5
Net Charge0
Average Mass408.579
Monoisotopic Mass408.28757
SMILESC=C1CCC2C(C)(C)CC(O)CC2(C)C1CCC(C)CCOC(=O)CCC(=O)O
InChIInChI=1S/C24H40O5/c1-16(12-13-29-22(28)11-10-21(26)27)6-8-19-17(2)7-9-20-23(3,4)14-18(25)15-24(19,20)5/h16,18-20,25H,2,6-15H2,1,3-5H3,(H,26,27)
InChIKeyRJFVWGBZBUWHAM-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-[5-(7-hydroxy-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-3-methylpentoxy]-4-oxobutanoic acid (CHEBI:181504) is a diterpenoid (CHEBI:23849)
IUPAC Name 
4-[5-(7-hydroxy-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-3-methylpentoxy]-4-oxobutanoic acid
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