Chem
J-GLOBAL ID：200907016281394898
Nikkaji number：J1.198.818K
(17S)-17-Hydroxy-6β,7β:15β,16β-dimethano-3-oxo(1,1,2,2-3H4)pregn-4-ene-21-carboxylic acid γ-lactone
(17S)-17-ヒドロキシ-6β,7β:15β,16β-ジメタノ-3-オキソ(1,1,2,2-3H4)プレグナ-4-エン-21-カルボン酸γ-ラクトン
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
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
Molecular formula： C24H26[3H]4O3
Molecular formula furigana： C24-H30-O3
Molecular weight： 374.533
InChI：
InChI=1S/C24H30O3/c1-22-6-3-12(25)9-17(22)13-10-14(13)20-16(22)4-7-23(2)21(20)15-11-18(15)24(23)8-5-19(26)27-24/h9,13-16,18,20-21H,3-8,10-11H2,1-2H3/t13-,14+,15-,16+,18+,20-,21+,22-,23+,24+/m1/s1/i3T2,6T2
InChI key：
METQSPRSQINEEU-VRQDPWBFSA-N
SMILES：
C1([3H])([3H])C(=O)C=C2[C@@H]3C[C@@H]3[C@H]3[C@@H]4[C@@H]5C[C@@H]5[C@@]5(CCC(=O)O5)[C@@]4(C)CC[C@@H]3[C@@]2(C)C1([3H])[3H]
Systematic name (3)：
- (17S)-17-ヒドロキシ-6β,7β:15β,16β-ジメタノ-3-オキソ(1,1,2,2-3H4)プレグナ-4-エン-21-カルボン酸γ-ラクトン
- (1R,2R,4R,10R,11S,14S,15S,16S,18S,19S)-10,14-ジメチル(8,8,9,9-3H4)スピロ[ヘキサシクロ[9.8.0.02,4.05,10.014,19.016,18]ノナデカン-15,2'-オキソラン]-5-エン-5',7-ジオン
- (1R,2R,4R,10R,11S,14S,15S,16S,18S,19S)-10,14-dimethyl(8,8,9,9-3H4)spiro[hexacyclo[9.8.0.02,4.05,10.014,19.016,18]nonadecane-15,2'-oxolan]-5-ene-5',7-dione
- (17S)-17-Hydroxy-6β,7β:15β,16β-dimethano-3-oxo(1,1,2,2-3H4)pregn-4-ene-21-carboxylic acid γ-lactone
Return to Previous Page
