Chem
J-GLOBAL ID：200907075147602472
Nikkaji number：J1.307.754A
9,12,13-Trihydroxy-10-octadecenoic acid
9,12,13-トリヒドロキシ-10-オクタデセン酸
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Molecular formula： C18H34O5
Molecular formula furigana： C18-H34-O5
Molecular weight： 330.465
InChI：
InChI=1S/C18H34O5/c1-2-3-7-11-16(20)17(21)14-13-15(19)10-8-5-4-6-9-12-18(22)23/h13-17,19-21H,2-12H2,1H3,(H,22,23)
InChI key：
MDIUMSLCYIJBQC-UHFFFAOYSA-N
SMILES：
CCCCCC(O)C(O)C=CC(O)CCCCCCCC(=O)O
Systematic name (3)：
- 9,12,13-トリヒドロキシ-10-オクタデセン酸
- 9,12,13-トリヒドロキシオクタデカ-10-エン酸
- 9,12,13-trihydroxyoctadec-10-enoic acid
- 9,12,13-Trihydroxy-10-octadecenoic acid
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