Cervinomycin A1 triacetate
TL;DR: Cervinomycin A1 triacetate (CAS 104015-33-0) is a chemical compound with molecular formula C35H29NO12 and molecular weight 655.16895 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3,29-diacetyloxy-23,24-dimethoxy-10-methyl-5,27-dioxo-9,20-dioxa-6-azaheptacyclo[15.12.0.02,14.04,12.06,10.019,28.021,26]nonacosa-1(17),2,4(12),13,15,18,21,23,25,28-decaen-18-yl) acetate
Also Known As: Cervinomycin A1 triacetate, NIOSH/FK8980200, Cervinomycin A(sub 1), triacetate, 1,3a,8-trimethyl-1,2,3,3a,8,8a-hexahydro-pyrrolo[2,3-b]indol-5-ol,sulfate, (3,29-diacetyloxy-23,24-dimethoxy-10-methyl-5,27-dioxo-9,20-dioxa-6-azaheptacyclo[15.12.0.02,14.04,12.06,10.019,28.021,26]nonacosa-1(17),2,4(12),13,15,18,21,23,25,28-decaen-18-yl) acetate
Technical Specifications
| Molecular Formula | C35H29NO12 |
| Molecular Weight | 655.16895 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 153.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 8 |
| Exact Mass | 655.16895 Da |
| Heavy Atoms | 48 |
| Complexity | 1340.0 |
| SMILES | CC(=O)OC1=C2C(=C(C3=C1C=CC4=CC5=C(C(=C43)OC(=O)C)C(=O)N6CCOC6(C5)C)OC(=O)C)C(=O)C7=CC(=C(C=C7O2)OC)OC |
| InChIKey | DXKVVOOSWPPRHD-UHFFFAOYSA-N |
Chemical Property Profile of Cervinomycin A1 triacetate
Property Insights of Cervinomycin A1 triacetate
The XLogP value of 4.1 indicates that Cervinomycin A1 triacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 153.0 Ų indicates high polarity, suggesting Cervinomycin A1 triacetate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cervinomycin A1 triacetate has 0 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 Cervinomycin A1 triacetate?
The CAS number of Cervinomycin A1 triacetate is 104015-33-0.
What is the molecular formula of Cervinomycin A1 triacetate?
The molecular formula of Cervinomycin A1 triacetate is C35H29NO12.
What is the molecular weight of Cervinomycin A1 triacetate?
The molecular weight of Cervinomycin A1 triacetate is 655.16895 g/mol.
Where can I buy Cervinomycin A1 triacetate?
You can request a quote for Cervinomycin A1 triacetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Cervinomycin A1 triacetate?
Yes, CoreyChem provides custom synthesis services for Cervinomycin A1 triacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.