RXN0-305

Metabolite CPD-1083

• smiles:
  • CC=C(C)C(=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 key:
  • InChIKey=PMWATMXOQQZNBX-DKBZLLMOSA-J
• common name:
  • (E)-2-methylcrotonoyl-CoA
• molecular weight:
  • 845.604
• Synonym(s):
  • methylcrotonyl-CoA
  • trans-2-methylbut-2-enoyl-CoA
  • 2-methylbut-2-enoyl-CoA
  • tigloyl-CoA
  • tiglyl-CoA
  • 2-methyl-crotonyl-CoA
  • (E)-2-methylbut-2-enoyl-CoA

Reaction(s) known to produce the compound

• MCDH_2mb2coa

Reaction(s) of unknown directionality

• TIGLYLCOA-HYDROXY-RXN
• RXN-14266

External links

• CAS : 6247-62-7
• PUBCHEM:
  • 45266534
• CHEBI:
  • 15478
• LIGAND-CPD:
  • C03345
• HMDB : HMDB02054

"CC=C(C)C(=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-" cannot be used as a page name in this wiki.