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Substance Name: beta-D-Allofuranuronic acid, 5-((2-amino-1-oxooctyl)amino)-1,5-dideoxy-1-(3,4-dihydro-2,4-dioxo-1(2H)-pyrimidinyl)-, (R)-
RN: 112139-14-7
InChIKey: BMZGICVERRDKPA-KMENYQFWSA-N

Molecular Formula

  • C19-H30-N4-O8

Molecular Weight

  • 442.466
 
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Names and Synonyms

  • beta-D-Allofuranuronic acid, 5-((2-amino-1-oxooctyl)amino)-1,5-dideoxy-1-(3,4-dihydro-2,4-dioxo-1(2H)-pyrimidinyl)-, (R)-

Registry Numbers

CAS Registry Number

  • 112139-14-7

System Generated Number

  • 0112139147

Structure Descriptors

InChI

1S/C19H30N4O8/c1-2-3-4-5-6-7-10(20)16(27)22-12(18(28)29)15-13(25)14(26)17(31-15)23-9-8-11(24)21-19(23)30/h8-10,12-15,17,25-26H,2-7,20H2,1H3,(H,22,27)(H,28,29)(H,21,24,30)/t10-,12+,13+,14-,15?,17-/m1/s1

InChIKey

BMZGICVERRDKPA-KMENYQFWSA-N

Smiles

CCCCCCC[C@H](C(=O)N[C@@H](C1[C@H]([C@H]([C@@H](O1)n2ccc(=O)[nH]c2=O)O)O)C(=O)O)N