诺加霉素
TL;DR: 诺加霉素 (CAS 1404-15-5) is a chemical compound with molecular formula C39H49NO16 and molecular weight 787.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
诺加霉素
methyl 23-(dimethylamino)-4,8,12,22,24-pentahydroxy-1,12-dimethyl-6,17-dioxo-10-(3,4,5-trimethoxy-4,6-dimethyloxan-2-yl)oxy-20,25-dioxahexacyclo[19.3.1.02,19.05,18.07,16.09,14]pentacosa-2,4,7(16),8,14,18-hexaene-13-carboxylate
Also Known As: nogalamycin, Nogalomycin, Antibiotic 205t3, Antibiotic NSC 70845, HSCI1_000252
| Molecular Formula | C39H49NO16 |
|---|---|
| Molecular Weight | 787.31 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 229.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 8 |
| Exact Mass | 787.3051 |
| Heavy Atoms | 56 |
| Complexity | 1530.0 |
Chemical Identifiers
| CAS Number | 1404-15-5 |
|---|---|
| SMILES | CC1C(C(C(C(O1)OC2CC(C(C3=CC4=C(C(=C23)O)C(=O)C5=C(C=C6C(=C5C4=O)OC7C(C(C(C6(O7)C)O)N(C)C)O)O)C(=O)OC)(C)O)OC)(C)OC)OC |
| InChIKey | KGTDRFCXGRULNK-UHFFFAOYSA-N |
Product Overview
诺加霉素 (CAS 1404-15-5), with molecular formula C39H49NO16 and molecular weight 787.31 g/mol. IUPAC: methyl 23-(dimethylamino)-4,8,12,22,24-pentahydroxy-1,12-dimethyl-6,17-dioxo-10-(3,4,5-trimethoxy-4,6-dimethyloxan-2-yl)oxy-20,25-dioxahexacyclo[19.3.1.02,19.05,18.07,16.09,14]pentacosa-2,4,7(16),8,14,18-hexaene-13-carboxylate.
Chemical Property Profile of 诺加霉素
Property Insights of 诺加霉素
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 诺加霉素. The TPSA of 229.0 Ų indicates high polarity, suggesting 诺加霉素 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 诺加霉素 has 5 hydrogen bond donor(s) and 17 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 诺加霉素?
The CAS number of 诺加霉素 is 1404-15-5.
What is the molecular formula of 诺加霉素?
The molecular formula of 诺加霉素 is C39H49NO16.
What is the molecular weight of 诺加霉素?
The molecular weight of 诺加霉素 is 787.31 g/mol.
Where can I buy 诺加霉素?
You can request a quote for 诺加霉素 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 诺加霉素?
Yes, KEHONG BIO provides custom synthesis services for 诺加霉素 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.