Chemical Compound

S-(Phenylmethyl)coenzyme A

CAS Registry Number 1001416-34-7
S-(Phenylmethyl)coenzyme A chemical structure
Primary Record

S-(Phenylmethyl)coenzyme A

In stock
1,231 g
Purity
98.7 %
CAS
1001416-34-7

Compound Identifiers & Properties

CAS
1001416-34-7
PubChem CID
175675882
SMILES
CC(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)[C@H](C(=O)NCCC(=O)NCCSCC4=CC=CC=C4)O
Canonical SMILES
CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(=O)NCCC(=O)NCCSCc1ccccc1

Names & Synonyms

  • S-(Phenylmethyl)coenzyme A
  • 1001416-34-7