Chemical Compound

3-Methylglutaconyl-CoA

CAS Registry Number 6247-73-0
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3-Methylglutaconyl-CoA chemical structure
Primary Record

3-Methylglutaconyl-CoA

In stock
8,728 g
Purity
99.6 %
CAS
6247-73-0

Compound Identifiers & Properties

CAS
6247-73-0
PubChem CID
1142
SMILES
CC(=CC(=O)SCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O)CC(=O)O
Canonical SMILES
CC(=CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)CC(=O)O

Names & Synonyms

  • 3-Methylglutaconyl-CoA
  • AC1L1ATK
  • CTK2F2200
  • CID1142
  • 3-Methylglutaconyl-CoA (achiral)
  • GXKSHRDAHFLWPN-UHFFFAOYSA-N
  • 2,6-dimethyl-octa-2,6-dienedioic acid
  • 6247-73-0
  • 5-[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]ethylsulfanyl]-3-methyl-5-oxopent-3-enoic acid
  • 3-Methyl Glutaconyl CoA (mixture of regioisomers)
  • Q2816002
  • Mixture of S-(5-Hydrogen 3-Methyl-2-pentenedioate) Coenzyme A and S-(5-Hydrogen 3-Methyl-3-pentenedioate) Coenzyme A