phosphocholine

Chemical Formula:

C₅H₁₃NO₄P

Molecular Weight:

182.136 Daltons

Monoisotopic Mass:

184.0738694851 Daltons

SMILES:

C[N+](CCOP([O-])([O-])=O)(C)C

InChI:

1S/C5H14NO4P/c1-6(2,3)4-5-10-11(7,8)9/h4-5H2,1-3H3,(H-,7,8,9)/p-1

InChIKey:

YHHSONZFOIEMCP-UHFFFAOYSA-M

Synonyms

Databases

MetaCyc: PHOSPHORYL-CHOLINE

RefMet: Choline phosphate

MetaboLights: MTBLC295975

HMDB: HMDB01565

ChemSpider: 2578067

ChEBI: 295975 18132

PubChem (CID): 3330960 135437

KEGG: C00588

CAS: 107-73-3

Seed: cpd00457

MetaNetX: MNXM229

PupChem (SID): 3867

CHEMBL: CHEMBL1235161 CHEMBL3350840

KNApSAcK: C00007299

PDB-CCD: PC

3DMET: B00141

NIKKAJI: J215.288F