myristoyl-CoA

Chemical Formula:

C₃₅H₅₈N₇O₁₇P₃S

Molecular Weight:

973.861 Daltons

Monoisotopic Mass:

977.3135738223 Daltons

SMILES:

CCCCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)(OCC1(C(OP([O-])(=O)[O-])C(O)C(O1)N3(C2(=C(C(N)=NC=N2)N=C3))))[O-])[O-]

InChI:

1S/C35H62N7O17P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-26(44)63-19-18-37-25(43)16-17-38-33(47)30(46)35(2,3)21-56-62(53,54)59-61(51,52)55-20-24-29(58-60(48,49)50)28(45)34(57-24)42-23-41-27-31(36)39-22-40-32(27)42/h22-24,28-30,34,45-46H,4-21H2,1-3H3,(H,37,43)(H,38,47)(H,51,52)(H,53,54)(H2,36,39,40)(H2,48,49,50)/p-4/t24-,28-,29-,30+,34-/m1/s1

InChIKey:

DUAFKXOFBZQTQE-QSGBVPJFSA-J

Synonyms

n-C14:0CoA
tetradecanoyl-CoA

Databases

MetaCyc: TETRADECANOYL-COA

RefMet: Myristoyl-CoA

BiGG: tdcoa

MetaboLights: MTBLC57385

HMDB: HMDB01521

ChEBI: 57385 15532

PubChem (CID): 25244582 11966124

KEGG: C02593

Reactome: 77272

Seed: cpd01695

MetaNetX: MNXM224

PupChem (SID): 5585

CHEMBL: CHEMBL1949899

NIKKAJI: J589.553G