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Substance Name: Adenosine-N(6)-methyl-propylthioether-N-pyridoxamine
RN: 125162-97-2
InChIKey: XLRAIUMUVOXBBC-CIVUBGFFSA-N

Note

  • Vitamin B6 tumor product.

Molecular Formula

  • C22-H31-N7-O6-S

Molecular Weight

  • 521.596
 
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Names and Synonyms

Name of Substance

  • Adenosine-N(6)-methyl-propylthioether-N-pyridoxamine

Synonyms

  • Amptep
  • N-(((3-(((3-Hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinyl)methyl)amino)propyl)thio)methyl)adenosine

Systematic Name

  • Adenosine, N-(((3-(((3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinyl)methyl)amino)propyl)thio)methyl)-

Registry Numbers

CAS Registry Number

  • 125162-97-2

System Generated Number

  • 0125162972

Structure Descriptors

InChI

1S/C22H31N7O6S/c1-12-17(32)14(13(7-30)5-24-12)6-23-3-2-4-36-11-28-20-16-21(26-9-25-20)29(10-27-16)22-19(34)18(33)15(8-31)35-22/h5,9-10,15,18-19,22-23,30-34H,2-4,6-8,11H2,1H3,(H,25,26,28)/t15-,18-,19-,22-/m1/s1

InChIKey

XLRAIUMUVOXBBC-CIVUBGFFSA-N

Smiles

OC[C@@H]1[C@@H](O)[C@@H](O)[C@@H](O1)n1cnc2c(NCSCCCNCc3c(c(ncc3CO)C)O)ncnc12