Chemical Compound

3-amino-N-[(1S)-2-[[(1S)-2-[[(1S,2R,3S)-1-(cyclohexylmethyl)-2,3-dihydroxy-5-methyl-hexyl]amino]-1-(1H-imidazol-5-ylmethyl)-2-oxo-ethyl]amino]-1-[(4-methoxyphenyl)methyl]-2-oxo-ethyl]-3-methyl-butanamide

CAS Registry Number 113082-98-7
3-amino-N-[(1S)-2-[[(1S)-2-[[(1S,2R,3S)-1-(cyclohexylmethyl)-2,3-dihydroxy-5-methyl-hexyl]amino]-1-(1H-imidazol-5-ylmethyl)-2-oxo-ethyl]amino]-1-[(4-methoxyphenyl)methyl]-2-oxo-ethyl]-3-methyl-butanamide 结构式
Primary record

3-amino-N-[(1S)-2-[[(1S)-2-[[(1S,2R,3S)-1-(cyclohexylmethyl)-2,3-dihydroxy-5-methyl-hexyl]amino]-1-(1H-imidazol-5-ylmethyl)-2-oxo-ethyl]amino]-1-[(4-methoxyphenyl)methyl]-2-oxo-ethyl]-3-methyl-butanamide

库存
7,047 克
纯度
98.9 %
CAS
113082-98-7

化合物标识与属性

CAS
113082-98-7
PubChem CID
60594
SMILES
CC(C)C[C@@H]([C@@H]([C@H](CC1CCCCC1)NC(=O)[C@H](CC2=CN=CN2)NC(=O)[C@H](CC3=CC=C(C=C3)OC)NC(=O)CC(C)(C)N)O)O
Canonical SMILES
COc1ccc(C[C@H](NC(=O)CC(C)(C)N)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N[C@@H](CC2CCCCC2)[C@@H](O)[C@@H](O)CC(C)C)cc1

名称与同义词

  • ENALKIREN
  • Enalquireno
  • Enalkirene
  • Enalkirenum
  • Enalkireno
  • Abbott-64662
  • Abbott 64662
  • Enalkirenum [INN-Latin]
  • Enalkirene [INN-French]
  • Enalkiren [USAN:INN]
  • Enalquireno [INN-Spanish]
  • 113082-98-7
  • ENALKIREN [INN]
  • Enalkiren (USAN/INN)
  • ENALKIREN [USAN]
  • RefChem:590787
  • D09ELW
  • ENALKIREN [MART.]
  • UNII-0U7YZ42Z47
  • AC1L1TK5
  • CHEMBL300337
  • 0U7YZ42Z47
  • SCHEMBL123107
  • SCHEMBL123108
  • DTXSID10150282
  • C35H56N6O6
  • CHEBI:4787
  • orb1986936
  • A-64662
  • DTXCID5072773
  • CID60594
  • ZINC3920420
  • BDBM50006202
  • A 64662; Abbott 64662
  • AKOS040748319
  • C35-H56-N6-O6
  • AN-5950
  • DB03395
  • DA-63187
  • HY-105276
  • J397.578I
  • LS-172211
  • A 64662
  • CS-0024915
  • NS00069578
  • 3-amino-N-[(2S)-1-[[(2S)-1-[[(2S,3R,4S)-1-cyclohexyl-3,4-dihydroxy-6-methylheptan-2-yl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-3-(4-methoxyphenyl)-1-oxopropan-2-yl]-3-methylbutanamide
  • C07466
  • D03738
  • Q27094330
  • L-Histidinamide, N-(3-amino-3-methyl-1-oxobutyl)-O-methyl-L-tyrosyl-N-(1-(cyclohexylmethyl)-2,3-dihydroxy-5-methylhexyl)-, (1S-(1R*,2S*,3R*))-
  • (alphaS)-alpha-((alphaS)-alpha-(3-Amino-3-methylbutyramido)-p-methoxyhydrocinnamamido)-N-((1S,2R,3S)-1-(cyclohexylmethyl)-2,3-dihydroxy-5-methylhexyl)imidazole-4-propionamide
  • (N-(3-amino-3-methyl-1-oxobutyl)-4-methoxy-L-phenylalanyl)-N-(1-(cyclohexylmethyl)-2,3-dihydroxy-5-methylhexyl)-L-histidinamide
  • 3-amino-N-[(1S)-2-[[(1S)-2-[[(1S,2R,3S)-1-(cyclohexylmethyl)-2,3-dihydroxy-5-methyl-hexyl]amino]-1-(1H-imidazol-5-ylmethyl)-2-oxo-ethyl]amino]-1-[(4-methoxyphenyl)methyl]-2-oxo-ethyl]-3-methyl-butanamide
  • (.ALPHA.S)-.ALPHA.-((.ALPHA.S)-.ALPHA.-(3-AMINO-3-METHYLBUTYRAMIDO)-P-METHOXYHYDROCINNAMAMIDO)-N-((1S,2R,3S)-1-(CYCLOHEXYLMETHYL)-2,3-DIHYDROXY-5-METHYLHEXYL)IMIDAZOLE-4-PROPIONAMIDE
  • (2S,3R,4S)-1-Cyclohexyl-2-[[N-(3-amino-3-methylbutanoyl)-O-methyl-L-Tyr-L-His-]amino]-6-methylheptane-3,4-diol
  • (Alpha-S)-Alpha-((Alpha-S)-Alpha-(3-Amino-3-Methylbutyramido)-p-Methoxyhydrocinnamamido)-N-((1S,2R,3S)-1-(Cyclohexylmethyl)-2,3-Dihydroxy-5-Methylhexyl)Imidazole-4-Propionamide
  • 3-amino-N-((1S)-2-(((1S)-2-(((1S,2R,3S)-1-(cyclohexylmethyl)-2,3-dihydroxy-5-methyl-hexyl)amino)-1-(1H-imidazol-5-ylmethyl)-2-oxo-ethyl)amino)-1-((4-methoxyphenyl)methyl)-2-oxo-ethyl)-3-methyl-butanamide
  • 3-Amino-N-((S)-1-(((S)-1-(((2S,3R,4S)-1-cyclohexyl-3,4-dihydroxy-6-methylheptan-2-yl)amino)-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl)amino)-3-(4-methoxyphenyl)-1-oxopropan-2-yl)-3-methylbutanamide
  • 3-amino-N-[(1S)-1-{[(1S)-1-{[(2S,3R,4S)-1-cyclohexyl-3,4-dihydroxy-6-methylheptan-2-yl]carbamoyl}-2-(1H-imidazol-4-yl)ethyl]carbamoyl}-2-(4-methoxyphenyl)ethyl]-3-methylbutanamide
  • 3-Amino-N-[1-[1-(1-cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexylcarbamoyl)-2-(1H-imidazol-4-yl)-ethylcarbamoyl]-2-(4-methoxy-phenyl)-ethyl]-3-methyl-butyramide
  • L-HISTIDINAMIDE, N-(3-AMINO-3-METHYL-1-OXOBUTYL)-O-METHYL-L-TYROSYL-N-((1S,2R,3S)-1-(CYCLOHEXYLMETHYL)-2,3-DIHYDROXY-5-METHYLHEXYL)-
  • N-(3-Amino-3-methylbutanoyl)-O-methyl-L-tyrosyl-N-[(2S,3R,4S)-1-cyclohexyl-3,4-dihydroxy-6-methylheptan-2-yl]-L-histidinamide