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Substance Name: S-(6-Purinyl)homocysteine
RN: 136040-01-2
InChIKey: ZIJLTJOOMWRTOD-YFKPBYRVSA-N

Note

  • 6-mercaptopurine metabolite is higher in kidney than in liver or plasma.

Molecular Formula

  • C9-H11-N5-O2-S

Molecular Weight

  • 253.2849
 
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Names and Synonyms

Name of Substance

  • S-(6-Purinyl)homocysteine

Synonyms

  • S-1H-Purin-6-yl-L-homocysteine
  • S-PHC

Systematic Name

  • L-Homocysteine, S-1H-purin-6-yl-

Registry Numbers

CAS Registry Number

  • 136040-01-2

System Generated Number

  • 0136040012

Structure Descriptors

InChI

1S/C9H11N5O2S/c10-5(9(15)16)1-2-17-8-6-7(12-3-11-6)13-4-14-8/h3-5H,1-2,10H2,(H,15,16)(H,11,12,13,14)/t5-/m0/s1

InChIKey

ZIJLTJOOMWRTOD-YFKPBYRVSA-N

Smiles

c1[nH]c(c-2ncnc2n1)SCC[C@@H](C(=O)O)N