α-ribazole 5'-phosphate

Chemical Formula:

C₁₄H₁₇N₂O₇P

Molecular Weight:

356.271 Daltons

Monoisotopic Mass:

358.092987485 Daltons

SMILES:

CC2(C(C)=CC1(N(C=NC=1C=2)C3(C(O)C(O)C(COP([O-])(=O)[O-])O3)))

InChI:

1S/C14H19N2O7P/c1-7-3-9-10(4-8(7)2)16(6-15-9)14-13(18)12(17)11(23-14)5-22-24(19,20)21/h3-4,6,11-14,17-18H,5H2,1-2H3,(H2,19,20,21)/p-2/t11-,12-,13-,14+/m1/s1

InChIKey:

ZMRGXEJKZPRBPJ-SYQHCUMBSA-L

Synonyms

N1-(5'-phospho-α-D-ribosyl)-5,6-dimethylbenzimidazole
DMB-ribose-5'-P
α-ribazole-5'-P

Databases

MetaCyc: ALPHA-RIBAZOLE-5-P

BiGG: 5prdmbz

ChEBI: 57918

PubChem (CID): 49791947

HMDB: HMDB03882

KEGG: C04778

Seed: cpd02904

MetaNetX: MNXM1224