Chem
J-GLOBAL ID：200907061084693765   Nikkaji number：J2.552.740B

13-Hydroxytotarane-6,8,11,13-tetraene-19-oic acid

13-ヒドロキシトタラン-6,8,11,13-テトラエン-19-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： C20H26O3
Molecular formula furigana： C20-H26-O3
Molecular weight： 314.425
InChI： InChI=1S/C20H26O3/c1-12(2)17-13-6-9-16-19(3,14(13)7-8-15(17)21)10-5-11-20(16,4)18(22)23/h6-9,12,16,21H,5,10-11H2,1-4H3,(H,22,23)/t16-,19-,20+/m1/s1
InChI key： UGFFVYQRVJCGSQ-AHRSYUTCSA-N
SMILES： CC(C)c1c(O)ccc2c1C=C[C@H]1[C@](C)(CCC[C@]21C)C(=O)O
Systematic name  (5)：
  • 1,2,3,4,4a,10aα-ヘキサヒドロ-7-ヒドロキシ-8-イソプロピル-1,4aβ-ジメチルフェナントレン-1β-カルボン酸
  • 13-ヒドロキシトタラン-6,8,11,13-テトラエン-19-酸
  • 1,4aβ-ジメチル-7-ヒドロキシ-8-イソプロピル-1,2,3,4,4a,10aα-ヘキサヒドロフェナントレン-1β-カルボン酸
  • (1S,4aS,10aR)-7-ヒドロキシ-1,4a-ジメチル-8-(プロパン-2-イル)-1,2,3,4,4a,10a-ヘキサヒドロフェナントレン-1-カルボン酸
  • (1S,4aS,10aR)-7-hydroxy-1,4a-dimethyl-8-(propan-2-yl)-1,2,3,4,4a,10a-hexahydrophenanthrene-1-carboxylic acid
Other name (3)：
  • 1,2,3,4,4a,10aα-Hexahydro-7-hydroxy-8-isopropyl-1,4aβ-dimethylphenanthrene-1β-carboxylic acid
  • 13-Hydroxytotarane-6,8,11,13-tetraene-19-oic acid
  • 1,4aβ-Dimethyl-7-hydroxy-8-isopropyl-1,2,3,4,4a,10aα-hexahydrophenanthrene-1β-carboxylic acid
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