L-Prolinamide, N-[[(4S)-hexahydro-1-methyl-2,6-dioxo-4-pyrimidinyl]carbonyl]-L-histidyl-, hydrate (1:4)

CAS Registry Number®

201677-75-0

CAS Name

L-Prolinamide, N-[[(4S)-hexahydro-1-methyl-2,6-dioxo-4-pyrimidinyl]carbonyl]-L-histidyl-, hydrate (1:4)

Molecular Formula

C17H23N7O5.4H2O

Cite this Page

L-Prolinamide, N-[[(4S)-hexahydro-1-methyl-2,6-dioxo-4-pyrimidinyl]carbonyl]-L-histidyl-, hydrate (1:4).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=201677-75-0 (retrieved 2024-11-22) (CAS RN: 201677-75-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C17H23N7O5.4H2O/c1-23-13(25)6-10(22-17(23)29)15(27)21-11(5-9-7-19-8-20-9)16(28)24-4-2-3-12(24)14(18)26;;;;/h7-8,10-12H,2-6H2,1H3,(H2,18,26)(H,19,20)(H,21,27)(H,22,29);4*1H2/t10-,11-,12-;;;;/m0..../s1

InChIKey

InChIKey=HRCJDWMUKPHPHR-NTFWNTCYSA-N

SMILES

C([C@H](CC1=CN=CN1)NC(=O)[C@@H]2CC(=O)N(C)C(=O)N2)(=O)N3[C@H](C(N)=O)CCC3.O

Canonical SMILES

O=C(N)C1N(C(=O)C(NC(=O)C2NC(=O)N(C(=O)C2)C)CC3=CN=CN3)CCC1.O

Other Names for this Substance

  • L-Prolinamide, N-[[(4S)-hexahydro-1-methyl-2,6-dioxo-4-pyrimidinyl]carbonyl]-L-histidyl-, hydrate (1:4)
  • L-Prolinamide, N-[[(4S)-hexahydro-1-methyl-2,6-dioxo-4-pyrimidinyl]carbonyl]-L-histidyl-, tetrahydrate
  • Taltirelin hydrate

CAS INSIGHTSTM
Hourglass and a clock