7-Dis-O-methylnogarol
TL;DR: 7-Dis-O-methylnogarol (CAS 64267-47-6) is a chemical compound with molecular formula C28H31NO10 and molecular weight 541.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,10S,21R,22R,23R,24S)-23-(dimethylamino)-4,8,12,22,24-pentahydroxy-10-methoxy-1,12-dimethyl-20,25-dioxahexacyclo[19.3.1.02,19.05,18.07,16.09,14]pentacosa-2,4,7(16),8,14,18-hexaene-6,17-dione
Also Known As: Menogarol, 7-Dis-O-methylnogarol, 2,6-Epoxy-2H-naphthaceno(1,2-b)oxocin-9,16-dione, 3,4,5,6,11,12,13,14-octahydro-4-(dimethylamino)-3,5,8,10,13-pentahydroxy-11-methoxy-6,13-dimethyl-, (2-alpha,3-beta,4-alpha,5-beta,6-alpha,11-alpha,13-alpha)-, 7-methoxy-3-[(7-methoxy-2-oxo-2H-chromen-3-yl)carbonyl]-2H-chromen-2-one, 2,6-Epoxy-2H-naphthaceno[1,2-b]oxocin-9,16-dione, 4-(dimethylamino)-3,4,5,6,11,12,13,14-octahydro-3,5,8,10,13-pentahydroxy-11-methoxy-6,13-dimethyl-, (2.alpha.,3.beta.,4.alpha.,5.beta.,6.alpha.,11.beta.,13.alpha.)-
| Molecular Formula | C28H31NO10 |
|---|---|
| Molecular Weight | 541.19 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 166.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 2 |
| Exact Mass | 541.1948 |
| Heavy Atoms | 39 |
| Complexity | 1020.0 |
Chemical Identifiers
| CAS Number | 64267-47-6 |
|---|---|
| SMILES | C[C@@]12[C@H]([C@H]([C@H]([C@@H](O1)OC3=C4C(=C(C=C23)O)C(=O)C5=C(C4=O)C=C6CC(C[C@@H](C6=C5O)OC)(C)O)O)N(C)C)O |
| InChIKey | LWYJUZBXGAFFLP-GHSKUSHPSA-N |
Product Overview
7-Dis-O-methylnogarol (CAS 64267-47-6), with molecular formula C28H31NO10 and molecular weight 541.19 g/mol. IUPAC: (1R,10S,21R,22R,23R,24S)-23-(dimethylamino)-4,8,12,22,24-pentahydroxy-10-methoxy-1,12-dimethyl-20,25-dioxahexacyclo[19.3.1.02,19.05,18.07,16.09,14]pentacosa-2,4,7(16),8,14,18-hexaene-6,17-dione.
Chemical Property Profile of 7-Dis-O-methylnogarol
Property Insights of 7-Dis-O-methylnogarol
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Dis-O-methylnogarol. The TPSA of 166.0 Ų indicates high polarity, suggesting 7-Dis-O-methylnogarol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 7-Dis-O-methylnogarol has 5 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 7-Dis-O-methylnogarol?
The CAS number of 7-Dis-O-methylnogarol is 64267-47-6.
What is the molecular formula of 7-Dis-O-methylnogarol?
The molecular formula of 7-Dis-O-methylnogarol is C28H31NO10.
What is the molecular weight of 7-Dis-O-methylnogarol?
The molecular weight of 7-Dis-O-methylnogarol is 541.19 g/mol.
Where can I buy 7-Dis-O-methylnogarol?
You can request a quote for 7-Dis-O-methylnogarol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Dis-O-methylnogarol?
Yes, KEHONG BIO provides custom synthesis services for 7-Dis-O-methylnogarol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.