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Substance Name: AFB1-N7-guanine
RN: 79982-94-8
InChIKey: GXTQFZWLCDHVQV-CKJDJMSUSA-N

Molecular Formula

  • C22-H17-N5-O8

Molecular Weight

  • 479.403
 
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Names and Synonyms

Results Name

  • AFB1-N7-guanine

Synonym

  • AFB1-N7-guanine

Systematic Name

  • Cyclopenta(c)furo(3',2':4,5)furo(2,3-h)(1)benzopyran-1,11-dione, 8-(2-amino-1,6-dihydro-6-oxo-9H-purin-9-yl)-2,3,6a,8,9,9a-hexahydro-9-hydroxy-4-methoxy-, (6aS-(6aalpha,8beta,9alpha,9aalpha))-

Registry Numbers

CAS Registry Number

  • 79982-94-8

System Generated Number

  • 0079982948

Structure Descriptors

InChI

1S/C22H17N5O8/c1-32-8-4-9-12(16-11(8)6-2-3-7(28)10(6)20(31)34-16)13-15(29)19(35-21(13)33-9)27-5-24-14-17(27)25-22(23)26-18(14)30/h4-5,13,15,19,21,29H,2-3H2,1H3,(H3,23,25,26,30)/t13-,15-,19-,21+/m1/s1

InChIKey

GXTQFZWLCDHVQV-CKJDJMSUSA-N

Smiles

O1[C@H]2[C@H](c3c(O2)cc(c2c3oc(c3c2CCC3=O)=O)OC)[C@H]([C@@H]1n1cnc2c1[nH]c(nc2=O)N)O