5-[2-[[6-[[(2S)-2-Amino-5-[(aminoiminomethyl)amino]-1-oxopentyl]amino]hexyl]amino]-2-oxoethyl]-2'-deoxyuridine 5'-(tetrahydrogen triphosphate)

Analyte Name

5-(2-((6-(((2S)-2-Amino-5-((aminoiminomethyl)amino)-1-oxopentyl)amino)hexyl)amino)-2-oxoethyl)-2'-deoxyuridine 5'-(tetrahydrogen triphosphate)

CAS Number

885109-28-4

Molecular Formula

C23 H43 N8 O16 P3

Molecular Weight

780.553

Accurate Mass

780.201

SMILES

N[C@H](CCCNC(=N)N)C(=O)NCCCCCCNC(=O)CC1=CN([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)C(=O)NC1=O

InChI

InChI=1S/C23H43N8O16P3/c24-15(6-5-9-29-22(25)26)21(35)28-8-4-2-1-3-7-27-18(33)10-14-12-31(23(36)30-20(14)34)19-11-16(32)17(45-19)13-44-49(40,41)47-50(42,43)46-48(37,38)39/h12,15-17,19,32H,1-11,13,24H2,(H,27,33)(H,28,35)(H,40,41)(H,42,43)(H4,25,26,29)(H,30,34,36)(H2,37,38,39)/t15-,16+,17-,19-/m1/s1

IUPAC

[[(2R,3S,5R)-5-[5-[2-[6-[[(2R)-2-amino-5-carbamimidamidopentanoyl]amino]hexylamino]-2-oxoethyl]-2,4-dioxopyrimidin-1-yl]-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat