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Substance Name: Carbamic acid, ((1S,2S)-3-((2S,5'S)-4-((1R)-2-((1,1-dimethylethyl)amino)-2-oxo-1-(phenylmethyl)ethyl)-2,3,4',5'-tetrahydro-2-(2-methylpropyl)-3,4'-dioxo-5'-(phenylmethyl)(2,3'-bi-1H-pyrrol)-5'-yl)-2-hydroxy-1-(phenylmethyl)propyl)-, (3S)-tetrahydro-3-furanyl ester
RN: 173091-97-9
InChIKey: CQYRFIYZAKSRRG-UPMBQMLSSA-N

Molecular Formula

  • C47-H58-N4-O7

Molecular Weight

  • 790.9962
 
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Names and Synonyms

  • Carbamic acid, ((1S,2S)-3-((2S,5'S)-4-((1R)-2-((1,1-dimethylethyl)amino)-2-oxo-1-(phenylmethyl)ethyl)-2,3,4',5'-tetrahydro-2-(2-methylpropyl)-3,4'-dioxo-5'-(phenylmethyl)(2,3'-bi-1H-pyrrol)-5'-yl)-2-hydroxy-1-(phenylmethyl)propyl)-, (3S)-tetrahydro-3-furanyl ester

Registry Numbers

CAS Registry Number

  • 173091-97-9

System Generated Number

  • 0173091979

Structure Descriptors

InChI

1S/C47H58N4O7/c1-31(2)25-47(41(53)37(28-49-47)36(43(55)51-45(3,4)5)23-32-15-9-6-10-16-32)38-29-48-46(42(38)54,26-34-19-13-8-14-20-34)27-40(52)39(24-33-17-11-7-12-18-33)50-44(56)58-35-21-22-57-30-35/h6-20,28-29,31,35-36,39-40,48-49,52H,21-27,30H2,1-5H3,(H,50,56)(H,51,55)/t35-,36+,39-,40-,46-,47-/m0/s1

InChIKey

CQYRFIYZAKSRRG-UPMBQMLSSA-N

Smiles

CC(C)C[C@@]1(C(=O)C(=CN1)[C@@H](Cc2ccccc2)C(=O)NC(C)(C)C)C3=CN[C@@](C3=O)(Cc4ccccc4)C[C@@H]([C@H](Cc5ccccc5)NC(=O)O[C@H]6CCOC6)O