Gougerotin

CAS Registry Number®

2096-42-6
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CAS Name

Gougerotin

Molecular Formula

C16H25N7O8

Molecular Mass

443.41

Cite this Page

Gougerotin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=2096-42-6 (retrieved 2024-05-21) (CAS RN: 2096-42-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C16H25N7O8/c1-19-4-8(25)20-6(5-24)14(29)22-9-10(26)11(27)15(31-12(9)13(18)28)23-3-2-7(17)21-16(23)30/h2-3,6,9-12,15,19,24,26-27H,4-5H2,1H3,(H2,18,28)(H,20,25)(H,22,29)(H2,17,21,30)/t6-,9+,10+,11-,12+,15-/m1/s1

InChIKey

InChIKey=AMNAZJFEONUVTD-QJHHURCWSA-N

SMILES

O[C@H]1[C@@H](O[C@H](C(N)=O)[C@@H](NC([C@H](NC(CNC)=O)CO)=O)[C@@H]1O)N2C(=O)N=C(N)C=C2

Canonical SMILES

O=C1N=C(N)C=CN1C2OC(C(=O)N)C(NC(=O)C(NC(=O)CNC)CO)C(O)C2O

Other Names for this Substance

  • β-D-Glucopyranuronamide, 1-(4-amino-2-oxo-1(2H)-pyrimidinyl)-1,4-dideoxy-4-[(N-methylglycyl-D-seryl)amino]-
  • Gougerotin
  • Glucopyranuronamide, 1-(4-amino-2-oxo-1(2H)-pyrimidinyl)-1,4-dideoxy-4-[D-2-[2-(methylamino)acetamido]hydracrylamido]-, β-D-
  • β-D-Glucopyranuronamide, 1-(4-amino-2-oxo-1(2H)-pyrimidinyl)-1,4-dideoxy-4-[[N-(N-methylglycyl)-D-seryl]amino]-
  • 1-(4-Amino-2-oxo-1(2H)-pyrimidinyl)-1,4-dideoxy-4-[(N-methylglycyl-D-seryl)amino]-β-D-glucopyranuronamide

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Deleted or Replaced CAS Registry Numbers

11027-42-2, 17650-96-3, 25630-85-7, 41744-55-2

CAS INSIGHTSTM
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