Chem
J-GLOBAL ID：200907026957116328
Nikkaji number：J1.346.662I
Versisponic acid C
ベルシスポン酸C
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： C33H50O5
Molecular formula furigana： C33-H50-O5
Molecular weight： 526.758
InChI：
InChI=1S/C33H50O5/c1-19(2)20(3)10-11-22(29(36)37)25-18-28(38-21(4)34)33(9)24-12-13-26-30(5,6)27(35)15-16-31(26,7)23(24)14-17-32(25,33)8/h19,22,25-26,28H,3,10-18H2,1-2,4-9H3,(H,36,37)/t22-,25-,26+,28+,31-,32-,33-/m1/s1
InChI key：
HGKYZLMBDDTARR-VPDRPMEHSA-N
SMILES：
CC(C)C(=C)CC[C@H]([C@H]1C[C@H](OC(=O)C)[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CCC(=O)C(C)(C)[C@@H]1CC3)C(=O)O
Systematic name (4)：
- 3-オキソ-15α-アセトキシ-24-メチレンラノスタ-8-エン-21-酸
- 15α-アセトキシ-3-オキソ-24-メチレン-5α-ラノスタ-8-エン-21-酸
- (2R)-2-[(1R,3S,3aR,5aR,9aS,11aR)-3-(アセチルオキシ)-3a,6,6,9a,11a-ペンタメチル-7-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]-6-メチル-5-メチリデンヘプタン酸
- (2R)-2-[(1R,3S,3aR,5aR,9aS,11aR)-3-(acetyloxy)-3a,6,6,9a,11a-pentamethyl-7-oxo-1H,2H,3H,3aH,4H,5H,5aH,6H,7H,8H,9H,9aH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]-6-methyl-5-methylideneheptanoic acid
- 3-Oxo-15α-acetoxy-24-methylenelanost-8-en-21-oic acid
- ベルシスポン酸C
- Versisponic acid C
- 15α-Acetoxy-3-oxo-24-methylene-5α-lanost-8-en-21-oic acid
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