(5Z,8Z,11Z,14Z,17Z)-icosapentaenoyl-CoA
Chemical Formula:
C41H60N7O17P3S
Molecular Weight:
1047.943 Daltons
Monoisotopic Mass:
1051.3292238865 Daltons
SMILES:
CCC=CCC=CCC=CCC=CCC=CCCCC(=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/C41H64N7O17P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-32(50)69-25-24-43-31(49)22-23-44-39(53)36(52)41(2,3)27-62-68(59,60)65-67(57,58)61-26-30-35(64-66(54,55)56)34(51)40(63-30)48-29-47-33-37(42)45-28-46-38(33)48/h5-6,8-9,11-12,14-15,17-18,28-30,34-36,40,51-52H,4,7,10,13,16,19-27H2,1-3H3,(H,43,49)(H,44,53)(H,57,58)(H,59,60)(H2,42,45,46)(H2,54,55,56)/p-4/b6-5-,9-8-,12-11-,15-14-,18-17-/t30-,34-,35-,36+,40-/m1/s1
InChIKey:
Synonyms
- icosapentaenoyl-CoA
- (5Z,8Z,11Z,14Z,17Z)-eicosapentaenoyl-CoA
- (5Z,8Z,11Z,14Z,17Z)-eicosa-5,8,11,14,17-pentaenoyl-CoA
- (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoyl-CoA
- eicosapentaenoyl-CoA
Databases
MetaCyc:
CPD-14018
PubChem (CID):
71581014
ChEBI:
73862
Reactome:
2046059
HMDB:
HMDB60311
MetaNetX:
MNXM1449
KEGG:
C16165