Citreamicin alpha
TL;DR: Citreamicin alpha (CAS 122535-63-1) is a chemical compound with molecular formula C36H31NO12 and molecular weight 669.18463 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3-hydroxy-23,24-dimethoxy-7,7-dimethyl-5,8,18,27,29-pentaoxo-9,20-dioxa-6-azaheptacyclo[15.12.0.02,14.04,12.06,10.019,28.021,26]nonacosa-1(17),2,4(12),13,15,19(28),21,23,25-nonaen-10-yl)methyl 3-methylbutanoate
Also Known As: Citreamicin alpha, LL E19085alpha, LL-E19085alpha, (16-hydroxy-11,12-dimethoxy-1,1-dimethyl-2,8,14,15,17-pentaoxo-1,2,8,14,15,17-hexahydrochromeno[2',3':6,7]naphtho[2,1-g]oxazolo[3,2-b]isoquinolin-3a(4H)-yl)methyl 3-methylbutanoate, (3-Hydroxy-23,24-dimethoxy-7,7-dimethyl-5,8,18,27,29-pentaoxo-9,20-dioxa-6-azaheptacyclo[15.12.0.02,14.04,12.06,10.019,28.021,26]nonacosa-1(17),2,4(12),13,15,19(28),21,23,25-nonaen-10-yl)methyl 3-methylbutanoate
Technical Specifications
| Molecular Formula | C36H31NO12 |
| Molecular Weight | 669.18463 g/mol |
| XLogP | 5.2 |
| Topological Polar Surface Area (TPSA) | 172.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 7 |
| Exact Mass | 669.18463 Da |
| Heavy Atoms | 49 |
| Complexity | 1520.0 |
| SMILES | CC(C)CC(=O)OCC12CC3=C(C(=C4C(=C3)C=CC5=C4C(=O)C6=C(C5=O)OC7=CC(=C(C=C7C6=O)OC)OC)O)C(=O)N1C(C(=O)O2)(C)C |
| InChIKey | CWPZIGIUHZNJEJ-UHFFFAOYSA-N |
Chemical Property Profile of Citreamicin alpha
Property Insights of Citreamicin alpha
The XLogP value of 5.2 indicates that Citreamicin alpha is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 172.0 Ų indicates high polarity, suggesting Citreamicin alpha may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Citreamicin alpha has 1 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Citreamicin alpha?
The CAS number of Citreamicin alpha is 122535-63-1.
What is the molecular formula of Citreamicin alpha?
The molecular formula of Citreamicin alpha is C36H31NO12.
What is the molecular weight of Citreamicin alpha?
The molecular weight of Citreamicin alpha is 669.18463 g/mol.
Where can I buy Citreamicin alpha?
You can request a quote for Citreamicin alpha directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Citreamicin alpha?
Yes, CoreyChem provides custom synthesis services for Citreamicin alpha and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.