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Substance Name: beta-Methylene adenosine phosphosulfate
RN: 120975-36-2
InChIKey: KHJWGJQWZBBXEI-YNJARDAQSA-N

Molecular Formula

  • C11-H16-N5-O9-P-S

Molecular Weight

  • 425.313
 
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Names and Synonyms

Name of Substance

  • beta-Methylene adenosine phosphosulfate

Synonym

  • beta-Methylene aps

Systematic Name

  • Adenosine, 5'-(hydrogen (sulfomethyl)phosphonate)

Registry Numbers

CAS Registry Number

  • 120975-36-2

System Generated Number

  • 0120975362

Structure Descriptors

InChI

1S/C11H16N5O9PS/c12-9-6-10(14-2-13-9)16(3-15-6)11-8(18)7(17)5(25-11)1-24-26(19,20)4-27(21,22)23/h2-3,5,7-8,11,17-18H,1,4H2,(H,19,20)(H2,12,13,14)(H,21,22,23)/t5-,7-,8-,11?/m1/s1

InChIKey

KHJWGJQWZBBXEI-YNJARDAQSA-N

Smiles

C([C@@H]1[C@@H](O)[C@@H](O)[C@@H](O1)n1cnc2c(N)ncnc12)O[P@@](=O)(O)CS(=O)(=O)O