(3R)-hydroxy, 4-trans-undecenoyl-CoA

(3R)-hydroxy, 4-<i>trans</i>-undecenoyl-CoA




Chemical Formula:
C32H50N7O18P3S
Molecular Weight:
945.764 Daltons
Monoisotopic Mass:
949.2458881875999 Daltons
SMILES:
CCCCCCC=CC(O)CC(=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/C32H54N7O18P3S/c1-4-5-6-7-8-9-10-20(40)15-23(42)61-14-13-34-22(41)11-12-35-30(45)27(44)32(2,3)17-54-60(51,52)57-59(49,50)53-16-21-26(56-58(46,47)48)25(43)31(55-21)39-19-38-24-28(33)36-18-37-29(24)39/h9-10,18-21,25-27,31,40,43-44H,4-8,11-17H2,1-3H3,(H,34,41)(H,35,45)(H,49,50)(H,51,52)(H2,33,36,37)(H2,46,47,48)/p-4/b10-9+/t20-,21-,25-,26-,27+,31-/m1/s1
InChIKey:
ANVRIWFXMMCUPH-QYZXFXBMSA-J

Synonyms
  • (3R)-hydroxy, 4E-undecenoyl-CoA

Databases
MetaCyc:  CPD-15662
PubChem (CID):  122706089
MetaNetX:  MNXM147781