TL;DR: Cervinomycin A2 monoacetate (CAS 104015-36-3) is a chemical compound with molecular formula C31H23NO10 and molecular weight 569.1322 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(23,24-dimethoxy-10-methyl-5,18,27,29-tetraoxo-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-3-yl) acetate
Also Known As: Cervinomycin A2 monoacetate, (1H)Benzopyrano(2',3':6,7)naphth(2,1-g)oxazolo(3,2-b)isoquinoline-8,14,15,17-tetrone, 1,2,3a,4-tetrahydro-16-(acetyloxy)-11,12-dimethoxy-3a-methyl-, (-)-, (23,24-dimethoxy-10-methyl-5,18,27,29-tetraoxo-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-3-yl) acetate, 11,12-Dimethoxy-3a-methyl-8,14,15,17-tetraoxo-1,2,3a,4,8,14,15,17-octahydro[1]benzopyrano[2',3':6,7]naphtho[2,1-g][1,3]oxazolo[3,2-b]isoquinolin-16-yl acetate
| Molecular Formula | C31H23NO10 |
| Molecular Weight | 569.1322 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 135.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 569.1322 Da |
| Heavy Atoms | 42 |
| Complexity | 1280.0 |
| SMILES | CC(=O)OC1=C2C(=CC3=C1C(=O)N4CCOC4(C3)C)C=CC5=C2C(=O)C6=C(C5=O)OC7=CC(=C(C=C7C6=O)OC)OC |
| InChIKey | POJSNXOKEPJLSV-UHFFFAOYSA-N |
The XLogP value of 3.3 indicates that Cervinomycin A2 monoacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Cervinomycin A2 monoacetate. Following Lipinski's Rule of Five, Cervinomycin A2 monoacetate has 0 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Cervinomycin A2 monoacetate is 104015-36-3.
The molecular formula of Cervinomycin A2 monoacetate is C31H23NO10.
The molecular weight of Cervinomycin A2 monoacetate is 569.1322 g/mol.
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