Angelmicin B
TL;DR: Angelmicin B (CAS 151687-86-4) is a chemical compound with molecular formula C85H112O37 and molecular weight 1724.6882 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-[5-(5-acetyl-5-hydroxy-6-methyloxan-2-yl)oxy-6-methyloxan-2-yl]oxy-15-[9-[5-(5-acetyl-5-hydroxy-6-methyloxan-2-yl)oxy-6-methyloxan-2-yl]oxy-7-(4,5-dihydroxy-6-methyloxan-2-yl)oxy-1,8,10,10a,12-pentahydroxy-3,4-dimethoxy-11-oxo-10-propyl-6a,7,8,9-tetrahydro-6H-tetracen-2-yl]-7-(4,5-dihydroxy-6-methyloxan-2-yl)oxy-6,9,12,19-tetrahydroxy-16-methoxy-4-propyl-3-oxapentacyclo[9.8.0.02,8.04,9.013,18]nonadeca-1(11),12,15,18-tetraene-10,14,17-trione
Also Known As: Angelmicin B, 5-[5-(5-acetyl-5-hydroxy-6-methyloxan-2-yl)oxy-6-methyloxan-2-yl]oxy-15-[9-[5-(5-acetyl-5-hydroxy-6-methyloxan-2-yl)oxy-6-methyloxan-2-yl]oxy-7-(4,5-dihydroxy-6-methyloxan-2-yl)oxy-1,8,10,10a,12-pentahydroxy-3,4-dimethoxy-11-oxo-10-propyl-6a,7,8,9-tetrahydro-6H-tetracen-2-yl]-7-(4,5-dihydroxy-6-methyloxan-2-yl)oxy-6,9,12,19-tetrahydroxy-16-methoxy-4-propyl-3-oxapentacyclo[9.8.0.02,8.04,9.013,18]nonadeca-1(11),12,15,18-tetraene-10,14,17-trione
Technical Specifications
| Molecular Formula | C85H112O37 |
| Molecular Weight | 1724.6882 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 554.0 Ų |
| Hydrogen Bond Donors | 15 |
| Hydrogen Bond Acceptors | 37 |
| Rotatable Bonds | 22 |
| Exact Mass | 1724.6882 Da |
| Heavy Atoms | 122 |
| Complexity | 3890.0 |
| SMILES | CCCC1(C(C(C(C2C1(C(=O)C3=C(C4=C(C=C3C2)C(=C(C(=C4O)C5=C(C(=O)C6=C(C7=C(C(=C6C5=O)O)C(=O)C8(C9C7OC8(C(C(C9OC1CC(C(C(O1)C)O)O)O)OC1CCC(C(O1)C)OC1CCC(C(O1)C)(C(=O)C)O)CCC)O)O)OC)OC)OC)O)O)OC1CC(C(C(O1)C)O)O)O)OC1CCC(C(O1)C)OC1CCC(C(O1)C)(C(=O)C)O)O |
| InChIKey | XGHSXRXEPCUHTN-UHFFFAOYSA-N |
Chemical Property Profile of Angelmicin B
Property Insights of Angelmicin B
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Angelmicin B. The TPSA of 554.0 Ų indicates high polarity, suggesting Angelmicin B may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Angelmicin B has 15 hydrogen bond donor(s) and 37 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Angelmicin B?
The CAS number of Angelmicin B is 151687-86-4.
What is the molecular formula of Angelmicin B?
The molecular formula of Angelmicin B is C85H112O37.
What is the molecular weight of Angelmicin B?
The molecular weight of Angelmicin B is 1724.6882 g/mol.
Where can I buy Angelmicin B?
You can request a quote for Angelmicin B directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Angelmicin B?
Yes, CoreyChem provides custom synthesis services for Angelmicin B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.