Adriamycin semiquinone free radical
TL;DR: Adriamycin semiquinone free radical (CAS 73025-63-5) is a chemical compound with molecular formula C27H31NO11 and molecular weight 545.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-2,5,6,11,12-pentahydroxy-7-methoxy-3,4-dihydro-1H-tetracen-2-yl]-2-hydroxyethanone
Also Known As: Adriamycin semiquinone free radical, (8S-cis)-10-((3-Amino-2,3,6-trideoxy-alpha-L-lyxo-hexapyranosyl)oxy)-7,8,9,10-tetrahydro-6,8,11,12-tetrahydro-8-(hydroxyacetyl)-1-methoxy-5-naphthacenyloxy, 5-Naphthacenyloxy, 10-((3-amino-2,3,6-trideoxy-alpha-L-lyxo-hexapyranosyl)oxy)-7,8,9,10-tetrahydro-6,8,11,12-tetrahydro-8-(hydroxyacetyl)-1-methoxy-, (8S-cis)-, 1-[4-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-2,5,6,11,12-pentahydroxy-7-methoxy-3,4-dihydro-1H-tetracen-2-yl]-2-hydroxyethanone, 3,5,6,11,12-Pentahydroxy-3-(hydroxyacetyl)-10-methoxy-1,2,3,4-tetrahydrotetracen-1-yl 3-amino-2,3,6-trideoxyhexopyranoside
| Molecular Formula | C27H31NO11 |
|---|---|
| Molecular Weight | 545.19 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 212.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 5 |
| Exact Mass | 545.1897 |
| Heavy Atoms | 39 |
| Complexity | 894.0 |
Chemical Identifiers
| CAS Number | 73025-63-5 |
|---|---|
| SMILES | CC1C(C(CC(O1)OC2CC(CC3=C(C4=C(C5=C(C(=CC=C5)OC)C(=C4C(=C23)O)O)O)O)(C(=O)CO)O)N)O |
| InChIKey | HNPNGLGEXIWMNH-UHFFFAOYSA-N |
Product Overview
Adriamycin semiquinone free radical (CAS 73025-63-5), with molecular formula C27H31NO11 and molecular weight 545.19 g/mol. IUPAC: 1-[4-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-2,5,6,11,12-pentahydroxy-7-methoxy-3,4-dihydro-1H-tetracen-2-yl]-2-hydroxyethanone.
Chemical Property Profile of Adriamycin semiquinone free radical
Property Insights of Adriamycin semiquinone free radical
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Adriamycin semiquinone free radical. The TPSA of 212.0 Ų indicates high polarity, suggesting Adriamycin semiquinone free radical may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Adriamycin semiquinone free radical has 8 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 Adriamycin semiquinone free radical?
The CAS number of Adriamycin semiquinone free radical is 73025-63-5.
What is the molecular formula of Adriamycin semiquinone free radical?
The molecular formula of Adriamycin semiquinone free radical is C27H31NO11.
What is the molecular weight of Adriamycin semiquinone free radical?
The molecular weight of Adriamycin semiquinone free radical is 545.19 g/mol.
Where can I buy Adriamycin semiquinone free radical?
You can request a quote for Adriamycin semiquinone free radical directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Adriamycin semiquinone free radical?
Yes, KEHONG BIO provides custom synthesis services for Adriamycin semiquinone free radical and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.