1',2'-Dihydro-2',6-dihydroxyrotenone
TL;DR: 1',2'-Dihydro-2',6-dihydroxyrotenone (CAS 91062-86-1) is a chemical compound with molecular formula C23H24O8 and molecular weight 428.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,6R,13R)-13-hydroxy-6-(2-hydroxypropan-2-yl)-16,17-dimethoxy-2,7,20-trioxapentacyclo[11.8.0.03,11.04,8.014,19]henicosa-3(11),4(8),9,14,16,18-hexaen-12-one
Also Known As: 12a-hydroxydalpanol, DH-2,6-OH-rotenone, 1',2'-Dihydro-2',6-dihydroxyrotenone, NCI60_016219, (1R,6R,13R)-13-hydroxy-6-(2-hydroxypropan-2-yl)-16,17-dimethoxy-2,7,20-trioxapentacyclo[11.8.0.03,11.04,8.014,19]henicosa-3(11),4(8),9,14,16,18-hexaen-12-one
| Molecular Formula | C23H24O8 |
|---|---|
| Molecular Weight | 428.15 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 428.14713 |
| Heavy Atoms | 31 |
| Complexity | 712.0 |
Chemical Identifiers
| CAS Number | 91062-86-1 |
|---|---|
| SMILES | CC(C)([C@H]1CC2=C(O1)C=CC3=C2O[C@@H]4COC5=CC(=C(C=C5[C@@]4(C3=O)O)OC)OC)O |
| InChIKey | NSFCLBVWJYYZMR-DNVFCKCGSA-N |
Product Overview
1',2'-Dihydro-2',6-dihydroxyrotenone (CAS 91062-86-1), with molecular formula C23H24O8 and molecular weight 428.15 g/mol. IUPAC: (1R,6R,13R)-13-hydroxy-6-(2-hydroxypropan-2-yl)-16,17-dimethoxy-2,7,20-trioxapentacyclo[11.8.0.03,11.04,8.014,19]henicosa-3(11),4(8),9,14,16,18-hexaen-12-one.
Chemical Property Profile of 1',2'-Dihydro-2',6-dihydroxyrotenone
Property Insights of 1',2'-Dihydro-2',6-dihydroxyrotenone
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1',2'-Dihydro-2',6-dihydroxyrotenone. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1',2'-Dihydro-2',6-dihydroxyrotenone. Following Lipinski's Rule of Five, 1',2'-Dihydro-2',6-dihydroxyrotenone has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1',2'-Dihydro-2',6-dihydroxyrotenone?
The CAS number of 1',2'-Dihydro-2',6-dihydroxyrotenone is 91062-86-1.
What is the molecular formula of 1',2'-Dihydro-2',6-dihydroxyrotenone?
The molecular formula of 1',2'-Dihydro-2',6-dihydroxyrotenone is C23H24O8.
What is the molecular weight of 1',2'-Dihydro-2',6-dihydroxyrotenone?
The molecular weight of 1',2'-Dihydro-2',6-dihydroxyrotenone is 428.15 g/mol.
Where can I buy 1',2'-Dihydro-2',6-dihydroxyrotenone?
You can request a quote for 1',2'-Dihydro-2',6-dihydroxyrotenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1',2'-Dihydro-2',6-dihydroxyrotenone?
Yes, KEHONG BIO provides custom synthesis services for 1',2'-Dihydro-2',6-dihydroxyrotenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.