Primary Record
SCHEMBL1331947
- In stock
- 8,967 g
- Purity
- 99.2 %
- CAS
- 72059-49-5
Compound Identifiers & Properties
- CAS
- 72059-49-5
- PubChem CID
- 87229140
- SMILES
- CCCCCCCCCC(CC(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(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)O)O
- Canonical SMILES
- CCCCCCCCCC(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
Names & Synonyms
- SCHEMBL1331947
- Coenzyme A, S-(3-hydroxydodecanoate)
- 72059-49-5