Chemical Compound

AC1MDBP9

CAS Registry Number 103476-21-7
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AC1MDBP9 chemical structure
Primary Record

AC1MDBP9

In stock
7,822 g
Purity
98.1 %
CAS
103476-21-7

Compound Identifiers & Properties

CAS
103476-21-7
PubChem CID
2786979
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)NCCSC(=O)CC(C)(CC(=O)O)O)O.[Na+].[Na+]
Canonical SMILES
CC(O)(CC(=O)O)CC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(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-].[Na+].[Na+]

Names & Synonyms

  • AC1MDBP9
  • CID2786979
  • CID 2786979
  • CoenzymeA,S-(hydrogen3-hydroxy-3-methylpentanedioate),disodiumsalt
  • 103476-21-7
  • Coenzyme A, S-(hydrogen 3-hydroxy-3-methyl pentanedioate), disodium salt
  • disodium [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-2-[[[[(3R)-4-[[3-[2-(3,5-dihydroxy-3-methyl-5-oxopentanoyl)sulfanylethylamino]-3-oxopropyl]amino]-3-hydroxy-2,2-dimethyl-4-oxobutoxy]-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxymethyl]-4-hydroxyoxolan-3-yl] phosphate