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Substance Name: (2,3'-Bi-1H-pyrrole)-4-acetic acid, 5'-((2S,3S)-3-(((1,1-dimethylethoxy)carbonyl)amino)-2-hydroxy-4-phenylbutyl)-2,3,4',5'-tetrahydro-2-(2-methylpropyl)-3,4'-dioxo-alpha,5'-bis(phenylmethyl)-, methyl ester, (aR,2S,5'S)-
RN: 173091-93-5
InChIKey: QUDJJQVGSBUVMG-WYIKCZTRSA-N

Molecular Formula

  • C44-H53-N3-O7

Molecular Weight

  • 735.9167
 
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Names and Synonyms

  • (2,3'-Bi-1H-pyrrole)-4-acetic acid, 5'-((2S,3S)-3-(((1,1-dimethylethoxy)carbonyl)amino)-2-hydroxy-4-phenylbutyl)-2,3,4',5'-tetrahydro-2-(2-methylpropyl)-3,4'-dioxo-alpha,5'-bis(phenylmethyl)-, methyl ester, (aR,2S,5'S)-

Registry Numbers

CAS Registry Number

  • 173091-93-5

System Generated Number

  • 0173091935

Structure Descriptors

InChI

1S/C44H53N3O7/c1-29(2)24-44(38(49)34(27-46-44)33(40(51)53-6)22-30-16-10-7-11-17-30)35-28-45-43(39(35)50,25-32-20-14-9-15-21-32)26-37(48)36(23-31-18-12-8-13-19-31)47-41(52)54-42(3,4)5/h7-21,27-29,33,36-37,45-46,48H,22-26H2,1-6H3,(H,47,52)/t33-,36+,37+,43+,44+/m1/s1

InChIKey

QUDJJQVGSBUVMG-WYIKCZTRSA-N

Smiles

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