Primary Record
nchembio805-comp5d
- In stock
- 550 g
- Purity
- 98.1 %
Compound Identifiers & Properties
- PubChem CID
- 6857811
- SMILES
- CC(=O)C1=C(C=C2C=CC=C(C2=C1O)O)CC(=O)CC(=O)SCCNC(=O)CCNC(=O)[C@H](C(C)(C)COP(=O)([O-])OP(=O)([O-])OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)OP(=O)([O-])[O-])O
- Canonical SMILES
- CC(=O)c1c(CC(=O)CC(=O)SCCNC(=O)CCNC(=O)[C@@H](O)C(C)(C)COP(=O)([O-])OP(=O)([O-])OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@H](O)[C@@H]2OP(=O)([O-])[O-])cc2cccc(O)c2c1O
Names & Synonyms
- nchembio805-comp5d
- AC1OAH8T
- CID6857811
- 4-(3-Acetyl-4,5-dihydroxy-2-naphthyl)-3-oxobutanethioic acid S-Coenzyme A ester
- [(2R,3S,4R,5R)-2-[[[[(3S)-4-[[3-[2-[4-(3-acetyl-4,5-dihydroxynaphthalen-2-yl)-3-oxobutanoyl]sulfanylethylamino]-3-oxopropyl]amino]-3-hydroxy-2,2-dimethyl-4-oxobutoxy]-oxidophosphoryl]oxy-oxidophosphoryl]oxymethyl]-5-(6-aminopurin-9-yl)-4-hydroxyoxolan-3-yl] phosphate