Chem
J-GLOBAL ID:200907050052879792   Nikkaji number:J2.081.038F

3β,4β,5α,6β-Tetrahydroxy-1β,4bα,8β,10aα-tetramethyl-10-oxo-1,2,3,4,4aα,4b,5,6,7,8,10,10a-dodecahydrophenanthrene-2β-carboxylic acid 2,4-lactone

3β,4β,5α,6β-テトラヒドロキシ-1β,4bα,8β,10aα-テトラメチル-10-オキソ-1,2,3,4,4aα,4b,5,6,7,8,10,10a-ドデカヒドロフェナントレン-2β-カルボン酸2,4-ラクトン
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: C19H26O6
Molecular formula furigana: C19-H26-O6
Molecular weight: 350.411
InChI: InChI=1S/C19H26O6/c1-7-5-10(20)16(23)19(4)9(7)6-11(21)18(3)8(2)12-13(22)14(15(18)19)25-17(12)24/h6-8,10,12-16,20,22-23H,5H2,1-4H3/t7-,8+,10+,12-,13-,14-,15-,16-,18-,19+/m1/s1
InChI key: YRFDWLXOGCWEON-BJBYDMNGSA-N
SMILES: C[C@@H]1C[C@H](O)[C@@H](O)[C@]2(C)[C@@H]3[C@@H]4OC(=O)[C@@H]([C@H]4O)[C@H](C)[C@]3(C)C(=O)C=C12
Systematic name  (3):
  • 3β,4β,5α,6β-テトラヒドロキシ-1β,4bα,8β,10aα-テトラメチル-10-オキソ-1,2,3,4,4aα,4b,5,6,7,8,10,10a-ドデカヒドロフェナントレン-2β-カルボン酸2,4-ラクトン
  • (1S,2S,3R,4S,5S,7R,11S,12S,13R,16R)-4,5,16-トリヒドロキシ-3,7,11,12-テトラメチル-15-オキサテトラシクロ[11.2.1.02,11.03,8]ヘキサデカ-8-エン-10,14-ジオン
  • (1S,2S,3R,4S,5S,7R,11S,12S,13R,16R)-4,5,16-trihydroxy-3,7,11,12-tetramethyl-15-oxatetracyclo[11.2.1.02,11.03,8]hexadec-8-ene-10,14-dione
Other name (1):
  • 3β,4β,5α,6β-Tetrahydroxy-1β,4bα,8β,10aα-tetramethyl-10-oxo-1,2,3,4,4aα,4b,5,6,7,8,10,10a-dodecahydrophenanthrene-2β-carboxylic acid 2,4-lactone
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