Myristoleoyl-CoA

CAS Registry Number®

87935-97-5

CAS Name

Myristoleoyl-CoA

Molecular Formula

C35H60N7O17P3S

Molecular Mass

975.87

Cite this Page

Myristoleoyl-CoA.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=87935-97-5 (retrieved 2024-11-05) (CAS RN: 87935-97-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C35H60N7O17P3S/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/h7-8,22-24,28-30,34,45-46H,4-6,9-21H2,1-3H3,(H,37,43)(H,38,47)(H,51,52)(H,53,54)(H2,36,39,40)(H2,48,49,50)/b8-7-/t24-,28-,29-,30+,34-/m1/s1

InChIKey

InChIKey=GIIFECKTWKZXGU-FJXLYLFVSA-N

SMILES

O[C@H]1[C@H](N2C=3C(N=C2)=C(N)N=CN3)O[C@H](COP(OP(OCC([C@H](C(NCCC(NCCSC(CCCCCCC/C=C\CCCC)=O)=O)=O)O)(C)C)(=O)O)(=O)O)[C@H]1OP(=O)(O)O

Canonical SMILES

O=C(SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(N2C=NC=3C(=NC=NC32)N)C(O)C1OP(=O)(O)O)CCCCCCCC=CCCCC

Other Names for this Substance

  • Coenzyme A, S-(9Z)-9-tetradecenoate
  • Coenzyme A, S-9-tetradecenoate, (Z)-
  • Myristoleoyl-CoA
  • Myristoleoyl coenzyme A

CAS INSIGHTSTM
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