CHEBI:181009 - Radiclonic acid

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ChEBI Name Radiclonic acid
ChEBI ID CHEBI:181009
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C23H40O5
Net Charge 0
Average Mass 396.568
Monoisotopic Mass 396.28757
InChI InChI=1S/C23H40O5/c1-7-15(2)8-16(3)10-20(14-24)11-17(4)9-18(5)12-21(23(27)28)13-19(6)22(25)26/h9,12,15-17,19-20,24H,7-8,10-11,13-14H2,1-6H3,(H,25,26)(H,27,28)/b18-9+,21-12-
InChIKey NNPPLRJHBQPBAQ-UKRBZAIKSA-N
SMILES OCC(CC(CC(CC)C)C)CC(C)/C=C(/C=C(/CC(C)C(O)=O)\C(O)=O)\C
ChEBI Ontology
Outgoing Radiclonic acid (CHEBI:181009) is a diterpenoid (CHEBI:23849)
IUPAC Name
(2Z)-2-[(E)-6-(hydroxymethyl)-2,4,8,10-tetramethyldodec-2-enylidene]-4-methylpentanedioic acid
Manual Xref Database
24022677 ChemSpider
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