Colabomycin A
TL;DR: Colabomycin A (CAS 117778-57-1) is a chemical compound with molecular formula C30H30N2O7 and molecular weight 530.2053 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2E,4E,6E,8E)-N-[(1S,5S,6R)-5-hydroxy-5-[(1E,3E,5E,7E)-9-[(2-hydroxy-5-oxocyclopenten-1-yl)amino]-9-oxonona-1,3,5,7-tetraenyl]-2-oxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl]deca-2,4,6,8-tetraenamide
Also Known As: Colabomycin A, J1.120.918A, (2E,4E,6E,8E)-N-[(1S,5S,6R)-5-hydroxy-5-[(1E,3E,5E,7E)-9-[(2-hydroxy-5-oxocyclopenten-1-yl)amino]-9-oxonona-1,3,5,7-tetraenyl]-2-oxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl]deca-2,4,6,8-tetraenamide, (2E,4E,6E,8E)-N-[(1beta,6beta)-5alpha-Hydroxy-5-[(1E,3E,5E,7E)-9-[(2-hydroxy-5-oxo-1-cyclopentene-1-yl)amino]-9-oxo-1,3,5,7-nonatetrenyl]-2-oxo-7-oxabicyclo[4.1.0]hepta-3-ene-3-yl]-2,4,6,8-decatetrenamide, (2E,4E,6E,8E)-N-[(1S,5S,6R)-5-HYDROXY-5-[(1E,3E,5E,7E)-8-[(2-HYDROXY-5-OXOCYCLOPENT-1-EN-1-YL)CARBAMOYL]OCTA-1,3,5,7-TETRAEN-1-YL]-2-OXO-7-OXABICYCLO[4.1.0]HEPT-3-EN-3-YL]DECA-2,4,6,8-TETRAENAMIDE
Technical Specifications
| Molecular Formula | C30H30N2O7 |
| Molecular Weight | 530.2053 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 145.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 530.2053 Da |
| Heavy Atoms | 39 |
| Complexity | 1300.0 |
| SMILES | C/C=C/C=C/C=C/C=C/C(=O)NC1=C[C@]([C@H]2[C@@H](C1=O)O2)(/C=C/C=C/C=C/C=C/C(=O)NC3=C(CCC3=O)O)O |
| InChIKey | AVDIDFMWHMQFHM-ZNVBZEEFSA-N |
Chemical Property Profile of Colabomycin A
Property Insights of Colabomycin A
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Colabomycin A. The TPSA of 145.0 Ų indicates high polarity, suggesting Colabomycin A may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Colabomycin A has 4 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Colabomycin A?
The CAS number of Colabomycin A is 117778-57-1.
What is the molecular formula of Colabomycin A?
The molecular formula of Colabomycin A is C30H30N2O7.
What is the molecular weight of Colabomycin A?
The molecular weight of Colabomycin A is 530.2053 g/mol.
Where can I buy Colabomycin A?
You can request a quote for Colabomycin A directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Colabomycin A?
Yes, CoreyChem provides custom synthesis services for Colabomycin A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.