Coenzyme A, S-(2-carboxy-γ-oxobenzenebutanoate)

Modify Date: 2025-09-24 08:06:57

Coenzyme A, S-(2-carboxy-γ-oxobenzenebutanoate) Structure
Coenzyme A, S-(2-carboxy-γ-oxobenzenebutanoate) structure
Common Name Coenzyme A, S-(2-carboxy-γ-oxobenzenebutanoate)
CAS Number 97226-61-4 Molecular Weight 971.71300
Density 1.82±0.1 g/cm3(20 °C , 760mmHg) Boiling Point N/A
Molecular Formula C32H44N7O20P3S Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name Coenzyme A, S-(2-carboxy-γ-oxobenzenebutanoate)

 Chemical & Physical Properties

Density 1.82±0.1 g/cm3(20 °C , 760mmHg)
Molecular Formula C32H44N7O20P3S
Molecular Weight 971.71300
Exact Mass 971.15700
PSA 472.73000
LogP 1.38900
InChIKey KVAQAPQXOXTRAE-UHFFFAOYSA-N
SMILES CC(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCSC(=O)CCC(=O)c1ccccc1C(=O)O

 Precursor & DownStream

Precursor  0

DownStream  2

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