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CHEBI:141149 - ent-15-O-iso-valeroxy-kaur-16-en-19-oic acid

ChEBI IDCHEBI:141149
ChEBI Nameent-15-O-iso-valeroxy-kaur-16-en-19-oic acid
Stars
ASCII Nameent-15-O-iso-valeroxy-kaur-16-en-19-oic acid
Last Modified25 June 2018
Submittermwilliams
DownloadsMolfile
FormulaC25H38O4
Net Charge0
Average Mass402.575
Monoisotopic Mass402.27701
SMILES[H][C@]12CC[C@@]34C[C@@H](CC[C@@]3([H])[C@]1(C)CCC[C@@]2(C)C(=O)O)C(=C)[C@@H]4OC(=O)CC(C)C
InChIInChI=1S/C25H38O4/c1-15(2)13-20(26)29-21-16(3)17-7-8-19-23(4)10-6-11-24(5,22(27)28)18(23)9-12-25(19,21)14-17/h15,17-19,21H,3,6-14H2,1-2,4-5H3,(H,27,28)/t17-,18+,19+,21+,23-,24-,25-/m1/s1
InChIKeySEKFYFYIVMYTLS-IWLKZTELSA-N
ChEBI Ontology
Outgoing Relation(s)
ent-15-O-iso-valeroxy-kaur-16-en-19-oic acid (CHEBI:141149) is a tricyclic diterpenoid (CHEBI:79084)