Products 1066-12-2

CAS 1066-12-2 appears in our catalog under these names: 2–trans–Dodecenoyl–Co A, Dodec-2-trans-enoyl-CoA, 2-trans-Dodecenoyl-Co A, >86.0%(HPLC), Coenzyme A, S-(2E)-2-dodecenoate, 86.0%, 86.0%. Offered by: GLPBio, MedChemExpress, TCI, Chemat. Available pack sizes: 5mg, Get quote, 25mg.

2–trans–Dodecenoyl–Co A
GLPBio
  • size: 5mg
  • Variants: 1
from 1776.53
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Dodec-2-trans-enoyl-CoA
MedChemExpress
  • size: Get quote
  • Variants: 1
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2-trans-Dodecenoyl-Co A, >86.0%(HPLC)
TCI
  • size: 5mg, 25mg
  • Variants: 2
from 1009.86
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Coenzyme A, S-(2E)-2-dodecenoate, 86.0%, 86.0%
Chemat
  • size: 5mg, 25mg
  • Variants: 2
from 635.60
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Structural formula: {0} (CAS {1})

S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] (E)-dodec-2-enethioate (CAS 1066-12-2) is a chemical compound with the molecular formula C33H56N7O17P3S and a molecular weight of 947.8 g/mol. IUPAC name: S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] (E)-dodec-2-enethioate. InChIKey: IRFYVBULXZMEDE-DEEZISNZSA-N.

Identity
Molecular formulaC33H56N7O17P3S
Molecular weight947.8 g/mol
IUPAC nameS-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] (E)-dodec-2-enethioate
InChIKeyIRFYVBULXZMEDE-DEEZISNZSA-N
SMILESCCCCCCCCC/C=C/C(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O

Computed by PubChem (NCBI)

Synonyms: trans-Dodec-2-enoyl-CoA, Dodec-2-trans-enoyl-CoA, 2-trans-Dodecenoyl-CoA, 2E-dodecenoyl-CoA, Coenzyme A, S-(2E)-2-dodecenoate, 2-trans-Dodecenoyl-Co A, (2E)-Dodec-2-enoyl-CoA, starbld0014583, orb3144596
Related forms of this compound
S-[2-[3-[[4-[[[5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] dodec-2-enethioate C33H56N7O17P3S
Isomers (same molecular formula)
S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] (Z)-dodec-5-enethioate C33H56N7O17P3S
S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] dodec-11-enethioate C33H56N7O17P3S