Chem
J-GLOBAL ID：200907080568783496
Nikkaji number：J2.496.257A
Xylarenoic acid
キシラレン酸
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： C9H12O4
Molecular formula furigana： C9-H12-O4
Molecular weight： 184.191
InChI：
InChI=1S/C9H12O4/c1-3-4-5-8(9(11)12)6-13-7(2)10/h3-5H,6H2,1-2H3,(H,11,12)/b4-3+,8-5+
InChI key：
IIOKXVSQSQLJMO-SALQQRKASA-N
SMILES：
C/C=C/C=C(\COC(=O)C)/C(=O)O
Systematic name (3)：
- (2E,4E)-2-(アセトキシメチル)-2,4-ヘキサジエン酸
- (2E,4E)-2-[(アセチルオキシ)メチル]ヘキサ-2,4-ジエン酸
- (2E,4E)-2-[(acetyloxy)methyl]hexa-2,4-dienoic acid
- (2E,4E)-2-(Acetoxymethyl)-2,4-hexadienoic acid
- キシラレン酸
- Xylarenoic acid
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