Chem
J-GLOBAL ID：200907097837437788   Nikkaji number：J758.453I

30-Hydroxypristimerin

30-ヒドロキシプリスチメリン
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： C30H40O5
Molecular formula furigana： C30-H40-O5
Molecular weight： 480.645
InChI： InChI=1S/C30H40O5/c1-18-19-7-8-22-27(3,20(19)15-21(32)24(18)33)11-13-29(5)23-16-30(17-31,25(34)35-6)14-10-26(23,2)9-12-28(22,29)4/h7-8,15,23,31,33H,9-14,16-17H2,1-6H3/t23-,26+,27+,28-,29+,30-/m1/s1
InChI key： NAZWWCHBYOVCPI-IAPQBRSKSA-N
SMILES： COC(=O)[C@]1(CO)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=C(O)C(=O)C=C5[C@]4(C)CC[C@@]3(C)[C@@H]2C1)C
Systematic name  (3)：
  • 3,30-ジヒドロキシ-2-オキソ-24-ノルフリーデラ-1(10),3,5,7-テトラエン-29-酸メチル
  • メチル (2R,4aS,6aS,12bR,14aS,14bR)-10-ヒドロキシ-2-(ヒドロキシメチル)-4a,6a,9,12b,14a-ペンタメチル-11-オキソ-1,2,3,4,4a,5,6,6a,11,12b,13,14,14a,14b-テトラデカヒドロピセン-2-カルボキシラート
  • methyl (2R,4aS,6aS,12bR,14aS,14bR)-10-hydroxy-2-(hydroxymethyl)-4a,6a,9,12b,14a-pentamethyl-11-oxo-1,2,3,4,4a,5,6,6a,11,12b,13,14,14a,14b-tetradecahydropicene-2-carboxylate
Other name (3)：
  • 30-ヒドロキシプリスチメリン
  • 30-Hydroxypristimerin
  • 3,30-Dihydroxy-2-oxo-24-norfriedela-1(10),3,5,7-tetren-29-oic acid methyl ester
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