β-D-ribosylnicotinate

Chemical Formula:

C₁₁H₁₃NO₆

Molecular Weight:

255.227 Daltons

Monoisotopic Mass:

256.0821121872 Daltons

SMILES:

C(O)C1(C(O)C(O)C(O1)[N+]2(C=CC=C(C(=O)[O-])C=2))

InChI:

1S/C11H13NO6/c13-5-7-8(14)9(15)10(18-7)12-3-1-2-6(4-12)11(16)17/h1-4,7-10,13-15H,5H2/t7-,8-,9-,10-/m1/s1

InChIKey:

PUEDDPCUCPRQNY-ZYUZMQFOSA-N

Synonyms

Databases

MetaCyc: CPD-8259

PubChem (CID): 161233

MetaboLights: MTBLC58527

HMDB: HMDB06809

ChEBI: 58527

KEGG: C05841

RefMet: D-Ribosylnicotinate D-ribosylnicotinate

Reactome: 8869365

Seed: cpd03471

MetaNetX: MNXM1915