(1S,3aR,6aS)-(2S)-2-Cyclohexyl-N-(2-pyrazinylcarbonyl)glycyl-3-methyl-L-valyloctahydrocyclopenta[c]pyrrole-1-carboxylic acid

CAS Registry Number®

402958-98-9
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CAS Name

(1S,3aR,6aS)-(2S)-2-Cyclohexyl-N-(2-pyrazinylcarbonyl)glycyl-3-methyl-L-valyloctahydrocyclopenta[c]pyrrole-1-carboxylic acid

Molecular Formula

C27H39N5O5

Molecular Mass

513.63

Cite this Page

(1S,3aR,6aS)-(2S)-2-Cyclohexyl-N-(2-pyrazinylcarbonyl)glycyl-3-methyl-L-valyloctahydrocyclopenta[c]pyrrole-1-carboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=402958-98-9 (retrieved 2024-05-02) (CAS RN: 402958-98-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C27H39N5O5/c1-27(2,3)22(25(35)32-15-17-10-7-11-18(17)21(32)26(36)37)31-24(34)20(16-8-5-4-6-9-16)30-23(33)19-14-28-12-13-29-19/h12-14,16-18,20-22H,4-11,15H2,1-3H3,(H,30,33)(H,31,34)(H,36,37)/t17-,18-,20-,21-,22+/m0/s1

InChIKey

InChIKey=GUDVCEUDUGFATD-OOOLTRJPSA-N

SMILES

C([C@@H](NC([C@@H](NC(=O)C=1C=NC=CN1)C2CCCCC2)=O)[C@](C)(C)C)(=O)N3[C@H](C(O)=O)[C@@]4([C@](C3)(CCC4)[H])[H]

Canonical SMILES

O=C(NC(C(=O)NC(C(=O)N1CC2CCCC2C1C(=O)O)C(C)(C)C)C3CCCCC3)C4=NC=CN=C4

Other Names for this Substance

  • Cyclopenta[c]pyrrole-1-carboxylic acid, (2S)-2-cyclohexyl-N-(2-pyrazinylcarbonyl)glycyl-3-methyl-L-valyloctahydro-, (1S,3aR,6aS)-
  • Cyclopenta[c]pyrrole-1-carboxylic acid, (2S)-2-cyclohexyl-N-(pyrazinylcarbonyl)glycyl-3-methyl-L-valyloctahydro-, (1S,3aR,6aS)-
  • (1S,3aR,6aS)-(2S)-2-Cyclohexyl-N-(2-pyrazinylcarbonyl)glycyl-3-methyl-L-valyloctahydrocyclopenta[c]pyrrole-1-carboxylic acid

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