Chem
J-GLOBAL ID：200907001677258353
Nikkaji number：J2.596.133A
N-[6-[[(Cholesta-5-ene-3β-yloxy)carbonyl]amino]hexyl]carbamic acid
N-[6-[[(コレスタ-5-エン-3β-イルオキシ)カルボニル]アミノ]ヘキシル]カルバミド酸
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： C35H60N2O4
Molecular formula furigana： C35-H60-N2-O4
Molecular weight： 572.875
InChI：
InChI=1S/C35H60N2O4/c1-24(2)11-10-12-25(3)29-15-16-30-28-14-13-26-23-27(17-19-34(26,4)31(28)18-20-35(29,30)5)41-33(40)37-22-9-7-6-8-21-36-32(38)39/h13,24-25,27-31,36H,6-12,14-23H2,1-5H3,(H,37,40)(H,38,39)/t25-,27+,28+,29-,30+,31+,34+,35-/m1/s1
InChI key：
ILOPFVOCZZXRMH-FWJKXKDPSA-N
SMILES：
CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(=O)NCCCCCCNC(=O)O
Systematic name (3)：
- N-[6-[[(コレスタ-5-エン-3β-イルオキシ)カルボニル]アミノ]ヘキシル]カルバミド酸
- {6-[({[(1R,3aS,3bS,7S,9aR,9bS,11aR)-9a,11a-ジメチル-1-[(2R)-6-メチルヘプタン-2-イル]-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-シクロペンタ[a]フェナントレン-7-イル]オキシ}カルボニル)アミノ]ヘキシル}カルバミン酸
- {6-[({[(1R,3aS,3bS,7S,9aR,9bS,11aR)-9a,11a-dimethyl-1-[(2R)-6-methylheptan-2-yl]-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-yl]oxy}carbonyl)amino]hexyl}carbamic acid
- N-[6-[[(Cholesta-5-ene-3β-yloxy)carbonyl]amino]hexyl]carbamic acid
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