Chem
J-GLOBAL ID：200907005420067307   Nikkaji number：J594.277B

2α,3β-Dihydroxy-7-oxa-B-homo-5α-pregnane-6,20-dione

2α,3β-ジヒドロキシ-7-オキサ-B-ホモ-5α-プレグナン-6,20-ジオン
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： C21H32O5
Molecular formula furigana： C21-H32-O5
Molecular weight： 364.482
InChI： InChI=1S/C21H32O5/c1-11(22)13-4-5-14-12-10-26-19(25)16-8-17(23)18(24)9-21(16,3)15(12)6-7-20(13,14)2/h12-18,23-24H,4-10H2,1-3H3/t12-,13+,14-,15-,16+,17+,18+,20+,21+/m0/s1
InChI key： MNJMQGBUHCWHRY-LBPQYPLMSA-N
SMILES： CC(=O)[C@H]1CC[C@H]2[C@@H]3COC(=O)[C@H]4C[C@@H](O)[C@H](O)C[C@]4(C)[C@H]3CC[C@]12C
Systematic name  (3)：
  • 2α,3β-ジヒドロキシ-7-オキサ-B-ホモ-5α-プレグナン-6,20-ジオン
  • (1S,2R,4R,5R,7S,11S,12S,15S,16S)-15-アセチル-4,5-ジヒドロキシ-2,16-ジメチル-9-オキサテトラシクロ[9.7.0.02,7.012,16]オクタデカン-8-オン
  • (1S,2R,4R,5R,7S,11S,12S,15S,16S)-15-acetyl-4,5-dihydroxy-2,16-dimethyl-9-oxatetracyclo[9.7.0.02,7.012,16]octadecan-8-one
Other name (1)：
  • 2α,3β-Dihydroxy-7-oxa-B-homo-5α-pregnane-6,20-dione
Thsaurus map：
Thesaurus Map

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