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CHEBI:63668 - abieta-7,13-dien-18,18-diol

ChEBI IDCHEBI:63668
ChEBI Nameabieta-7,13-dien-18,18-diol
Stars
DefinitionAn aldehyde hydrate resulting from the addition of water to the aldehyde group of abietal.
Last Modified24 January 2012
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC20H32O2
Net Charge0
Average Mass304.474
Monoisotopic Mass304.24023
SMILES[H][C@@]12CC=C3C=C(C(C)C)CC[C@]3([H])[C@@]1(C)CCC[C@@]2(C)C(O)O
InChIInChI=1S/C20H32O2/c1-13(2)14-6-8-16-15(12-14)7-9-17-19(16,3)10-5-11-20(17,4)18(21)22/h7,12-13,16-18,21-22H,5-6,8-11H2,1-4H3/t16-,17+,19+,20+/m0/s1
InChIKeyCPTVDNMRGYWJCH-ONCXSQPRSA-N
ChEBI Ontology
Outgoing Relation(s)
abieta-7,13-dien-18,18-diol (CHEBI:63668) has parent hydride abieta-7,13-diene (CHEBI:30232)
abieta-7,13-dien-18,18-diol (CHEBI:63668) is a aldehyde hydrate (CHEBI:63733)
UniProt Name  Source
abieta-7,13-dien-18,18-diolUniProt
Citations