CHEBI:781 - 17-Oxogrindelic acid

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ChEBI Name 17-Oxogrindelic acid
ChEBI ID CHEBI:781
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C20H30O4
Net Charge 0
Average Mass 334.451
Monoisotopic Mass 334.21441
InChI InChI=1S/C20H30O4/c1-17(2)8-5-9-19(4)15(17)7-6-14(13-21)20(19)11-10-18(3,24-20)12-16(22)23/h6,13,15H,5,7-12H2,1-4H3,(H,22,23)/t15-,18-,19-,20+/m0/s1
InChIKey ATEDUZJBBLDWGB-MVJPYGJCSA-N
SMILES C[C@@]1(CC(O)=O)CC[C@@]2(O1)C(C=O)=CC[C@H]1C(C)(C)CCC[C@]21C
ChEBI Ontology
Outgoing 17-Oxogrindelic acid (CHEBI:781) is a diterpenoid (CHEBI:23849)
Synonym Source
17-Oxogrindelic acid KEGG COMPOUND
Manual Xrefs Databases
C00003462 KNApSAcK
C09150 KEGG COMPOUND
View more database links
Registry Number Type Source
151625-35-3 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014