Chem
J-GLOBAL ID：200907053759397009
Nikkaji number：J2.496.246F
(1R,5S,7S)-4-[[(1R)-2β-Hydroxy-2-methyl-6α-[(E)-3,3-dimethyl-1-butenyl]cyclohexane-1β-yl]carbonyl]-10,10-dimethyl-3-thia-4-azatricyclo[5.2.1.01,5]decane3,3-dioxide
(1R,5S,7S)-4-[[(1R)-2β-ヒドロキシ-2-メチル-6α-[(E)-3,3-ジメチル-1-ブテニル]シクロヘキサン-1β-イル]カルボニル]-10,10-ジメチル-3-チア-4-アザトリシクロ[5.2.1.01,5]デカン3,3-ジオキシド
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： C24H39NO2[O-]2[S+2]
Molecular formula furigana： C24-H39-N-O4-S
Molecular weight： 437.640
InChI：
InChI=1S/C24H39NO4S/c1-21(2,3)12-9-16-8-7-11-23(6,27)19(16)20(26)25-18-14-17-10-13-24(18,22(17,4)5)15-30(25,28)29/h9,12,16-19,27H,7-8,10-11,13-15H2,1-6H3/b12-9+/t16-,17+,18+,19+,23+,24+/m1/s1
InChI key：
OQCBDKVTCVGISP-JFXAKHRLSA-N
SMILES：
CC(C)(C)/C=C/[C@H]1CCC[C@](C)(O)[C@@H]1C(=O)N1[C@H]2C[C@@H]3CC[C@@]2(C[S+2]1([O-])[O-])C3(C)C
Systematic name (3)：
- (1R,5S,7S)-4-[[(1R)-2β-ヒドロキシ-2-メチル-6α-[(E)-3,3-ジメチル-1-ブテニル]シクロヘキサン-1β-イル]カルボニル]-10,10-ジメチル-3-チア-4-アザトリシクロ[5.2.1.01,5]デカン3,3-ジオキシド
- (1R,5S,7S)-4-[(1R,2S,6R)-6-[(1E)-3,3-ジメチルブタ-1-エン-1-イル]-2-ヒドロキシ-2-メチルシクロヘキサンカルボニル]-10,10-ジメチル-3-チア-4-アザトリシクロ[5.2.1.01,5]デカン-3,3-ジイウム-3,3-ビス(オラート)
- (1R,5S,7S)-4-[(1R,2S,6R)-6-[(1E)-3,3-dimethylbut-1-en-1-yl]-2-hydroxy-2-methylcyclohexanecarbonyl]-10,10-dimethyl-3-thia-4-azatricyclo[5.2.1.01,5]decane-3,3-diium-3,3-bis(olate)
- (1R,5S,7S)-4-[[(1R)-2β-Hydroxy-2-methyl-6α-[(E)-3,3-dimethyl-1-butenyl]cyclohexane-1β-yl]carbonyl]-10,10-dimethyl-3-thia-4-azatricyclo[5.2.1.01,5]decane3,3-dioxide
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