succinylo-toyocamycin phosphate

Chemical Formula:

C₁₆H₁₄N₅O₁₁P

Molecular Weight:

483.287 Daltons

Monoisotopic Mass:

487.0740429569 Daltons

SMILES:

C(OP([O-])(=O)[O-])C1(C(O)C(O)C(O1)N3(C2(=C(C(=NC=N2)NC(C(=O)[O-])CC(=O)[O-])C(=C3)C#N)))

InChI:

1S/C16H18N5O11P/c17-2-6-3-21(15-12(25)11(24)8(32-15)4-31-33(28,29)30)14-10(6)13(18-5-19-14)20-7(16(26)27)1-9(22)23/h3,5,7-8,11-12,15,24-25H,1,4H2,(H,22,23)(H,26,27)(H,18,19,20)(H2,28,29,30)/p-4/t7?,8-,11-,12-,15+/m1/s1

InChIKey:

MQSLUNXYBIVDLF-NRRWQYMBSA-J

Synonyms

2-({5-cyano-7-[(1S,2S,3R,4R)-2,3-dihydroxy-4-[(phosphonatooxy)methyl]cyclopentyl]-3H,4H-pyrrolo[2,3-d]pyrimidin-4-yl}amino)butanedioate

Databases

MetaCyc: CPD-13099

PubChem (CID): 52940212

Seed: cpd23737

MetaNetX: MNXM12966