RefChem:296758
TL;DR: RefChem:296758 (CAS 66275-27-2) is a chemical compound with molecular formula C19H24O6 and molecular weight 348.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,8R,9S,12S,14R,16R)-8,14-dihydroxy-1,12-dimethyl-6-propan-2-yl-5,10-dioxatetracyclo[7.6.1.02,7.012,16]hexadeca-2,6-diene-4,11-dione
Also Known As: 1-Deoxy-2-hydroxynagilactone A, 4H,9H-Furo(2',3',4':4,5)naphtha(2,1-c)pyran-4,9-dione, 1,2,3,3a,5a,6,10b,10c-octahydro-2,6-dihydroxy-3a,10b-dimethyl-7-(1-methylethyl)-, (2R-(2alpha,3aalpha,5aalpha,6beta,10bbeta,10calpha))-, (1S,8R,9S,12S,14R,16R)-8,14-dihydroxy-1,12-dimethyl-6-(propan-2-yl)-5,10-dioxatetracyclo[7.6.1.02,7.012,16]hexadeca-2,6-diene-4,11-dione, (2R)-1,2,3,3a,5abeta,6,10b,10cbeta-Octahydro-2beta,6alpha-dihydroxy-3abeta,10balpha-dimethyl-7-isopropyl-4H,9H-furo[2 ,3 ,4 :4,5]naphtho[2,1-c]pyran-4,9-dione, (2R,3aS,5aS,6R,10bS,10cR)-2,6-Dihydroxy-3a,10b-dimethyl-7-(propan-2-yl)-1,2,3,3a,5a,6,10b,10c-octahydro-4H,9H-furo[2',3',4':4,5]naphtho[2,1-c]pyran-4,9-dione
| Molecular Formula | C19H24O6 |
|---|---|
| Molecular Weight | 348.16 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 93.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 348.1573 |
| Heavy Atoms | 25 |
| Complexity | 734.0 |
Chemical Identifiers
| CAS Number | 66275-27-2 |
|---|---|
| SMILES | CC(C)C1=C2[C@H]([C@@H]3[C@@H]4[C@@](C2=CC(=O)O1)(C[C@H](C[C@@]4(C(=O)O3)C)O)C)O |
| InChIKey | IKOMNWIZKFALLH-VYRPUYNWSA-N |
Product Overview
RefChem:296758 (CAS 66275-27-2), with molecular formula C19H24O6 and molecular weight 348.16 g/mol. IUPAC: (1S,8R,9S,12S,14R,16R)-8,14-dihydroxy-1,12-dimethyl-6-propan-2-yl-5,10-dioxatetracyclo[7.6.1.02,7.012,16]hexadeca-2,6-diene-4,11-dione.
Chemical Property Profile of RefChem:296758
Property Insights of RefChem:296758
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:296758. The TPSA of 93.1 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:296758. Following Lipinski's Rule of Five, RefChem:296758 has 2 hydrogen bond donor(s) and 6 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 RefChem:296758?
The CAS number of RefChem:296758 is 66275-27-2.
What is the molecular formula of RefChem:296758?
The molecular formula of RefChem:296758 is C19H24O6.
What is the molecular weight of RefChem:296758?
The molecular weight of RefChem:296758 is 348.16 g/mol.
Where can I buy RefChem:296758?
You can request a quote for RefChem:296758 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:296758?
Yes, KEHONG BIO provides custom synthesis services for RefChem:296758 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.