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Substance Name: PD 109488
RN: 103733-49-9
UNII: 482564RI35
InChIKey: NDDYKENLGBOEPD-HSQYWUDLSA-N

Note

  • A metabolite of quinapril.

Molecular Formula

  • C23-H24-N2-O4

Molecular Weight

  • 420.5062
 
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Names and Synonyms

Name of Substance

  • PD 109488

Synonyms

  • PD-109488
  • UNII-482564RI35

Systematic Name

  • 2H-Pyrazino(1,2-b)isoquinoline-2-acetic acid, 1,3,4,6,11,11a-hexahydro-3-methyl-1,4-dioxo-alpha-(2-phenylethyl)-, ethyl ester, (3S-(2(R*),3alpha-11abeta))-

Registry Numbers

CAS Registry Number

  • 103733-49-9

FDA UNII

  • 482564RI35

System Generated Number

  • 0103733499

Structure Descriptors

InChI

1S/C25H28N2O4/c1-3-31-25(30)21(14-13-18-9-5-4-6-10-18)27-17(2)23(28)26-16-20-12-8-7-11-19(20)15-22(26)24(27)29/h4-12,17,21-22H,3,13-16H2,1-2H3/t17-,21-,22-/m0/s1

InChIKey

NDDYKENLGBOEPD-HSQYWUDLSA-N

Smiles

CCOC(=O)[C@H](CCc1ccccc1)N2[C@H](C(=O)N3Cc4ccccc4C[C@H]3C2=O)C