Chem
J-GLOBAL ID:200907032259844389   Nikkaji number:J857.903B

(4E,8E,12Z)-14-[2-Hydroxy-3,4-dimethyl-5-(α-D-arabinopyranosyloxy)phenyl]-4,8,12-trimethyl-4,8,12-tetradecatrienoic acid

(4E,8E,12Z)-14-[2-ヒドロキシ-3,4-ジメチル-5-(α-D-アラビノピラノシルオキシ)フェニル]-4,8,12-トリメチル-4,8,12-テトラデカトリエン酸
Substance type:
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
Molecular formula: C30H44O8
Molecular formula furigana: C30-H44-O8
Molecular weight: 532.674
InChI: InChI=1S/C30H44O8/c1-18(9-7-11-20(3)13-15-26(32)33)8-6-10-19(2)12-14-23-16-25(21(4)22(5)27(23)34)38-30-29(36)28(35)24(31)17-37-30/h8,11-12,16,24,28-31,34-36H,6-7,9-10,13-15,17H2,1-5H3,(H,32,33)/b18-8+,19-12-,20-11+/t24-,28-,29+,30-/m1/s1
InChI key: BHNJFIZZQGJJRA-KWKKHZDLSA-N
SMILES: C/C(=C\CC/C(=C\Cc1cc(O[C@H]2OC[C@@H](O)[C@@H](O)[C@@H]2O)c(C)c(C)c1O)/C)/CC/C=C(\C)/CCC(=O)O
Systematic name  (3):
  • (4E,8E,12Z)-14-[2-ヒドロキシ-3,4-ジメチル-5-(α-D-アラビノピラノシルオキシ)フェニル]-4,8,12-トリメチル-4,8,12-テトラデカトリエン酸
  • (4E,8E,12Z)-14-(2-ヒドロキシ-3,4-ジメチル-5-{[(2R,3S,4R,5R)-3,4,5-トリヒドロキシオキサン-2-イル]オキシ}フェニル)-4,8,12-トリメチルテトラデカ-4,8,12-トリエン酸
  • (4E,8E,12Z)-14-(2-hydroxy-3,4-dimethyl-5-{[(2R,3S,4R,5R)-3,4,5-trihydroxyoxan-2-yl]oxy}phenyl)-4,8,12-trimethyltetradeca-4,8,12-trienoic acid
Other name (1):
  • (4E,8E,12Z)-14-[2-Hydroxy-3,4-dimethyl-5-(α-D-arabinopyranosyloxy)phenyl]-4,8,12-trimethyl-4,8,12-tetradecatrienoic acid
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