N-acetyl-β-neuraminate 9-phosphate

Chemical Formula:

C₁₁H₁₇NO₁₂P

Molecular Weight:

386.229 Daltons

Monoisotopic Mass:

389.0723116224 Daltons

SMILES:

CC(=O)NC1(C(CC(C([O-])=O)(O)O[CH]1C(O)C(O)COP([O-])([O-])=O)O)

InChI:

1S/C11H20NO12P/c1-4(13)12-7-5(14)2-11(19,10(17)18)24-9(7)8(16)6(15)3-23-25(20,21)22/h5-9,14-16,19H,2-3H2,1H3,(H,12,13)(H,17,18)(H2,20,21,22)/p-3/t5-,6+,7+,8+,9+,11-/m0/s1

InChIKey:

SQMNIXJSBCSNCI-PFQGKNLYSA-K

Synonyms

N-acetyl-β-neuraminate-9-P
N-acetyl-β-neuraminic acid 9-phosphate

Databases

MetaCyc: N-ACETYL-NEURAMINATE-9P

PubChem (CID): 90658964

MetaboLights: MTBLC27438

HMDB: HMDB04381

ChEBI: 27438

KEGG: C06241

MetaNetX: MNXM164937