Chem
J-GLOBAL ID:200907050507812101   Nikkaji number:J1.898.288I

N-Allyl-N-methyl-3α-[(3,5-dinitrophenyl)carbamoyloxy]-7α,12α-bis[(2-naphthyl)carbamoyloxy]cholane-24-amide

N-アリル-N-メチル-3α-[(3,5-ジニトロフェニル)カルバモイルオキシ]-7α,12α-ビス[(2-ナフチル)カルバモイルオキシ]コラン-24-アミド
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: C57H64N4[N+]2O9[O-]2
Molecular formula furigana: C57-H64-N6-O11
Molecular weight: 1009.170
InChI: InChI=1S/C57H64N6O11/c1-6-25-61(5)51(64)22-15-34(2)46-20-21-47-52-48(33-50(57(46,47)4)74-55(67)59-41-19-17-36-12-8-10-14-38(36)27-41)56(3)24-23-45(72-53(65)60-42-30-43(62(68)69)32-44(31-42)63(70)71)28-39(56)29-49(52)73-54(66)58-40-18-16-35-11-7-9-13-37(35)26-40/h6-14,16-19,26-27,30-32,34,39,45-50,52H,1,15,20-25,28-29,33H2,2-5H3,(H,58,66)(H,59,67)(H,60,65)/t34-,39?,45-,46-,47+,48+,49-,50+,52+,56+,57-/m1/s1
InChI key: RSBWFZOQAOEDNK-LANOCUGNSA-N
SMILES: C[C@H](CCC(=O)N(C)CC=C)[C@H]1CC[C@H]2[C@@H]3[C@@H](CC4C[C@@H](CC[C@]4(C)[C@H]3C[C@H](OC(=O)Nc3ccc4ccccc4c3)[C@]12C)OC(=O)Nc1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])OC(=O)Nc1ccc2ccccc2c1
Systematic name  (3):
  • N-アリル-N-メチル-3α-[(3,5-ジニトロフェニル)カルバモイルオキシ]-7α,12α-ビス[(2-ナフチル)カルバモイルオキシ]コラン-24-アミド
  • (1R,3aS,3bR,4R,7R,9aS,9bS,11S,11aR)-7-{[(3,5-ジニトロフェニル)カルバモイル]オキシ}-9a,11a-ジメチル-1-[(2R)-4-[メチル(プロパ-2-エン-1-イル)カルバモイル]ブタン-2-イル]-4-{[(ナフタレン-2-イル)カルバモイル]オキシ}-ヘキサデカヒドロ-1H-シクロペンタ[a]フェナントレン-11-イル N-(ナフタレン-2-イル)カルバマート
  • (1R,3aS,3bR,4R,7R,9aS,9bS,11S,11aR)-7-{[(3,5-dinitrophenyl)carbamoyl]oxy}-9a,11a-dimethyl-1-[(2R)-4-[methyl(prop-2-en-1-yl)carbamoyl]butan-2-yl]-4-{[(naphthalen-2-yl)carbamoyl]oxy}-hexadecahydro-1H-cyclopenta[a]phenanthren-11-yl N-(naphthalen-2-yl)carbamate
Other name (1):
  • N-Allyl-N-methyl-3α-[(3,5-dinitrophenyl)carbamoyloxy]-7α,12α-bis[(2-naphthyl)carbamoyloxy]cholane-24-amide
Thsaurus map:

Return to Previous Page