pantetheine

Chemical Formula:

C₁₁H₂₂N₂O₄S

Molecular Weight:

278.366 Daltons

Monoisotopic Mass:

278.130027895 Daltons

SMILES:

CC(C(O)C(=O)NCCC(NCCS)=O)(C)CO

InChI:

1S/C11H22N2O4S/c1-11(2,7-14)9(16)10(17)13-4-3-8(15)12-5-6-18/h9,14,16,18H,3-7H2,1-2H3,(H,12,15)(H,13,17)/t9-/m0/s1

InChIKey:

ZNXZGRMVNNHPCA-VIFPVBQESA-N

Synonyms

Databases

MetaCyc: CPD-511

RefMet: Pantetheine

MetaboLights: MTBLC16753

HMDB: HMDB03426

ChemSpider: 388453

PubChem (CID): 439322

ChEBI: 16753

KEGG: C00831

CAS: 496-65-1

Reactome: 8938313

Seed: cpd00620

MetaNetX: MNXM1154