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CHEBI:175296 - ent-1(10)-Halimene-15,19-dioic acid

ChEBI IDCHEBI:175296
ChEBI Nameent-1(10)-Halimene-15,19-dioic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H32O4
Net Charge0
Average Mass336.472
Monoisotopic Mass336.23006
SMILESCC(CCC1(C)C2=CCCC(C)(C(=O)O)C2CCC1C)CC(=O)O
InChIInChI=1S/C20H32O4/c1-13(12-17(21)22)9-11-19(3)14(2)7-8-16-15(19)6-5-10-20(16,4)18(23)24/h6,13-14,16H,5,7-12H2,1-4H3,(H,21,22)(H,23,24)
InChIKeyRGUIVLSKJWVPDX-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
ent-1(10)-Halimene-15,19-dioic acid (CHEBI:175296) is a carbocyclic fatty acid (CHEBI:35744)
IUPAC Name 
5-(4-carboxy-3-methylbutyl)-1,5,6-trimethyl-2,3,6,7,8,8a-hexahydronaphthalene-1-carboxylic acid
Manual XrefsDatabases
35014799ChemSpider
HMDB0039441HMDB