coformycin

Chemical Formula:

C₁₁H₁₇N₄O₅

Molecular Weight:

285.279 Daltons

Monoisotopic Mass:

285.119894677 Daltons

SMILES:

C3(NC=[N+]C1(=C(N=CN1C2(OC(CO)C(O)C2O))C3O))

InChI:

1S/C11H16N4O5/c16-2-6-8(18)9(19)11(20-6)15-4-14-7-5(17)1-12-3-13-10(7)15/h3-6,8-9,11,16-19H,1-2H2,(H,12,13)/p+1/t5-,6-,8-,9-,11-/m1/s1

InChIKey:

YOOVTUPUBVHMPG-LODYRLCVSA-O

Databases

MetaCyc: COFORMYCIN

RefMet: Coformycin

ChEBI: 57682

PubChem (CID): 46906033 25447

KEGG: C01677

NCI: 277817

CAS: 11033-22-0

Seed: cpd01159

MetaNetX: MNXM3950