CMP-NeuGc

CAS Registry Number®

98300-80-2

CAS Name

CMP-NeuGc

Molecular Formula

C20H31N4O17P

Molecular Mass

630.45

Cite this Page

CMP-NeuGc.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=98300-80-2 (retrieved 2024-12-22) (CAS RN: 98300-80-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C20H31N4O17P/c21-10-1-2-24(19(35)22-10)17-15(32)14(31)9(39-17)6-38-42(36,37)41-20(18(33)34)3-7(27)12(23-11(29)5-26)16(40-20)13(30)8(28)4-25/h1-2,7-9,12-17,25-28,30-32H,3-6H2,(H,23,29)(H,33,34)(H,36,37)(H2,21,22,35)/t7-,8+,9+,12+,13+,14+,15+,16+,17+,20+/m0/s1

InChIKey

InChIKey=HOEWKBQADMRCLO-UIUGZIMDSA-N

SMILES

O(P(OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N2C(=O)N=C(N)C=C2)(=O)O)[C@]3(C(O)=O)O[C@@]([C@@H]([C@@H](CO)O)O)([C@H](NC(CO)=O)[C@@H](O)C3)[H]

Canonical SMILES

O=C(O)C1(OC(C(O)C(O)CO)C(NC(=O)CO)C(O)C1)OP(=O)(O)OCC2OC(N3C=CC(=NC3=O)N)C(O)C2O

Other Names for this Substance

  • β-Neuraminic acid, N-(2-hydroxyacetyl)-, 2-(hydrogen 5′-cytidylate)
  • D-glycero-β-D-galacto-2-Nonulopyranosonic acid, 3,5-dideoxy-5-[(hydroxyacetyl)amino]-, 2-(hydrogen 5′-cytidylate)
  • β-Neuraminic acid, N-(hydroxyacetyl)-, 2-(hydrogen 5′-cytidylate)
  • CMP-NeuGc

CAS INSIGHTSTM
Pile of blue, green, and white color of capsule pills with modern design light.