阿黴素
TL;DR: 阿黴素 (CAS 23214-92-8) is a chemical compound with molecular formula C27H29NO11 and molecular weight 543.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
阿黴素
7-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-6,9,11-trihydroxy-9-(2-hydroxyacetyl)-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione
Also Known As: doxorubicin, Epirubicin, Triferric doxorubicin, Adriamycin, Adriblastin
| Molecular Formula | C27H29NO11 |
|---|---|
| Molecular Weight | 543.17 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 206.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 5 |
| Exact Mass | 543.1741 |
| Heavy Atoms | 39 |
| Complexity | 977.0 |
Chemical Identifiers
| CAS Number | 23214-92-8 |
|---|---|
| SMILES | CC1C(C(CC(O1)OC2CC(CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)(C(=O)CO)O)N)O |
| InChIKey | AOJJSUZBOXZQNB-UHFFFAOYSA-N |
Product Overview
阿黴素 (CAS 23214-92-8), with molecular formula C27H29NO11 and molecular weight 543.17 g/mol. IUPAC: 7-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-6,9,11-trihydroxy-9-(2-hydroxyacetyl)-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione.
Chemical Property Profile of 阿黴素
Property Insights of 阿黴素
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 阿黴素. The TPSA of 206.0 Ų indicates high polarity, suggesting 阿黴素 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 阿黴素 has 6 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 阿黴素?
The CAS number of 阿黴素 is 23214-92-8.
What is the molecular formula of 阿黴素?
The molecular formula of 阿黴素 is C27H29NO11.
What is the molecular weight of 阿黴素?
The molecular weight of 阿黴素 is 543.17 g/mol.
Where can I buy 阿黴素?
You can request a quote for 阿黴素 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 阿黴素?
Yes, KEHONG BIO provides custom synthesis services for 阿黴素 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.