1',2'-Dihydro-1'-6-dihydroxyrotenone
TL;DR: 1',2'-Dihydro-1'-6-dihydroxyrotenone (CAS 95397-29-8) 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.
13-hydroxy-6-(1-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: DH-1,6-OH-rotenone, 1',2'-Dihydro-1'-6-dihydroxyrotenone, 13-hydroxy-6-(1-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, 6a-Hydroxy-2-(1-hydroxypropan-2-yl)-8,9-dimethoxy-1,2,12,12a-tetrahydrofuro[2',3':7,8][1]benzopyrano[2,3-c][1]benzopyran-6(6aH)-one, RefChem:70641
| Molecular Formula | C23H24O8 |
|---|---|
| Molecular Weight | 428.15 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 428.14713 |
| Heavy Atoms | 31 |
| Complexity | 686.0 |
Chemical Identifiers
| CAS Number | 95397-29-8 |
|---|---|
| SMILES | CC(CO)C1CC2=C(O1)C=CC3=C2OC4COC5=CC(=C(C=C5C4(C3=O)O)OC)OC |
| InChIKey | XTJUCYLBEQGXJE-UHFFFAOYSA-N |
Product Overview
1',2'-Dihydro-1'-6-dihydroxyrotenone (CAS 95397-29-8), with molecular formula C23H24O8 and molecular weight 428.15 g/mol. IUPAC: 13-hydroxy-6-(1-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-1'-6-dihydroxyrotenone
Property Insights of 1',2'-Dihydro-1'-6-dihydroxyrotenone
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1',2'-Dihydro-1'-6-dihydroxyrotenone. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1',2'-Dihydro-1'-6-dihydroxyrotenone. Following Lipinski's Rule of Five, 1',2'-Dihydro-1'-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-1'-6-dihydroxyrotenone?
The CAS number of 1',2'-Dihydro-1'-6-dihydroxyrotenone is 95397-29-8.
What is the molecular formula of 1',2'-Dihydro-1'-6-dihydroxyrotenone?
The molecular formula of 1',2'-Dihydro-1'-6-dihydroxyrotenone is C23H24O8.
What is the molecular weight of 1',2'-Dihydro-1'-6-dihydroxyrotenone?
The molecular weight of 1',2'-Dihydro-1'-6-dihydroxyrotenone is 428.15 g/mol.
Where can I buy 1',2'-Dihydro-1'-6-dihydroxyrotenone?
You can request a quote for 1',2'-Dihydro-1'-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-1'-6-dihydroxyrotenone?
Yes, KEHONG BIO provides custom synthesis services for 1',2'-Dihydro-1'-6-dihydroxyrotenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.