Chem
J-GLOBAL ID：200907096314507956   Nikkaji number：J1.310.938I

3α-Hydroxy-7,11,23-trioxo-5α-lanosta-8-ene-26-oic acid methyl ester

3α-ヒドロキシ-7,11,23-トリオキソ-5α-ラノスタ-8-エン-26-酸メチル
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： C31H46O6
Molecular formula furigana： C31-H46-O6
Molecular weight： 514.703
InChI： InChI=1S/C31H46O6/c1-17(13-19(32)14-18(2)27(36)37-8)20-9-12-30(6)26-21(33)15-23-28(3,4)24(35)10-11-29(23,5)25(26)22(34)16-31(20,30)7/h17-18,20,23-24,35H,9-16H2,1-8H3/t17-,18?,20-,23+,24-,29+,30+,31-/m1/s1
InChI key： VLFJZMWZGXYRKS-WTUZDSOESA-N
SMILES： COC(=O)C(C)CC(=O)C[C@@H](C)[C@H]1CC[C@@]2(C)C3=C(C(=O)C[C@]12C)[C@@]1(C)CC[C@@H](O)C(C)(C)[C@@H]1CC3=O
Systematic name  (3)：
  • 3α-ヒドロキシ-7,11,23-トリオキソ-5α-ラノスタ-8-エン-26-酸メチル
  • メチル (6R)-6-[(1R,3aR,5aR,7R,9aS,11aR)-7-ヒドロキシ-3a,6,6,9a,11a-ペンタメチル-4,10-ジオキソ-1H,2H,3H,3aH,4H,5H,5aH,6H,7H,8H,9H,9aH,10H,11H,11aH-シクロペンタ[a]フェナントレン-1-イル]-2-メチル-4-オキソヘプタノアート
  • methyl (6R)-6-[(1R,3aR,5aR,7R,9aS,11aR)-7-hydroxy-3a,6,6,9a,11a-pentamethyl-4,10-dioxo-1H,2H,3H,3aH,4H,5H,5aH,6H,7H,8H,9H,9aH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]-2-methyl-4-oxoheptanoate
Other name (1)：
  • 3α-Hydroxy-7,11,23-trioxo-5α-lanosta-8-ene-26-oic acid methyl ester
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