Chem
J-GLOBAL ID：200907060320631087   Nikkaji number：J1.602.156C

(5S)-2-Isopropyl-5α,5aα,11aα-trihydroxy-9,9-dimethyl-5,5a,6,7,8,9,9aβ,10,11,11a-decahydro-3H-dibenzo[a,d]cycloheptene-3-one

(1R,2S,8R,11S)-1,2,8-トリヒドロキシ-12,12-ジメチル-6-(プロパン-2-イル)トリシクロ[9.4.0.03,8]ペンタデカ-3,6-ジエン-5-オン
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： C20H30O4
Molecular formula furigana： C20-H30-O4
Molecular weight： 334.456
InChI： InChI=1S/C20H30O4/c1-12(2)13-11-19(23)9-6-16-18(3,4)7-5-8-20(16,24)17(22)14(19)10-15(13)21/h10-12,16-17,22-24H,5-9H2,1-4H3/t16-,17-,19+,20+/m0/s1
InChI key： YBAJPKZQERPGQH-RAUXBKROSA-N
SMILES： CC(C)C1=C[C@]2(O)CC[C@H]3C(C)(C)CCC[C@]3(O)[C@@H](O)C2=CC1=O
Systematic name  (3)：
  • (5S)-2-イソプロピル-5α,5aα,11aα-トリヒドロキシ-9,9-ジメチル-5,5a,6,7,8,9,9aβ,10,11,11a-デカヒドロ-3H-ジベンゾ[a,d]シクロヘプテン-3-オン
  • (1R,2S,8R,11S)-1,2,8-トリヒドロキシ-12,12-ジメチル-6-(プロパン-2-イル)トリシクロ[9.4.0.03,8]ペンタデカ-3,6-ジエン-5-オン
  • (1R,2S,8R,11S)-1,2,8-trihydroxy-12,12-dimethyl-6-(propan-2-yl)tricyclo[9.4.0.03,8]pentadeca-3,6-dien-5-one
Other name (1)：
  • (5S)-2-Isopropyl-5α,5aα,11aα-trihydroxy-9,9-dimethyl-5,5a,6,7,8,9,9aβ,10,11,11a-decahydro-3H-dibenzo[a,d]cycloheptene-3-one
Thsaurus map：
Thesaurus Map

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