Diosbulbin C
TL;DR: Diosbulbin C (CAS 20086-07-1) is a chemical compound with molecular formula C19H22O7 and molecular weight 362.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R,5S,6R,8R,10R,11S,12S)-3-(furan-3-yl)-8-hydroxy-5-methyl-14-oxo-2,13-dioxatetracyclo[10.2.1.01,5.06,11]pentadecane-10-carboxylic acid
Also Known As: Diosbulbin C, (2R,6S,6aS,7R,9R,10aR,10bS)-2-(furan-3-yl)-9-hydroxy-10b-methyl-4-oxodecahydro-3a,6-methanofuro[2,3-d][2]benzoxepine-7(4H)-carboxylic acid, (2R,6S,6aS,7R,9R,10aR,10bS)-2-(Furan-3-yl)-9-hydroxy-10b-methyl-4-oxodecahydro-4H-3a,6-methanofuro[2,3-d][2]benzoxepine-7-carboxylic acid, (3R,5S,6R,8R,10R,11S,12S)-3-(FURAN-3-YL)-8-HYDROXY-5-METHYL-14-OXO-2,13-DIOXATETRACYCLO[10.2.1.0(1),?.0?,(1)(1)]PENTADECANE-10-CARBOXYLIC ACID, 2-(Furan-3-yl)-9-hydroxy-10b-methyl-4-oxodecahydro-4H-3a,6-methanofuro[2,3-d][2]benzoxepine-7-carboxylic acid
| Molecular Formula | C19H22O7 |
|---|---|
| Molecular Weight | 362.14 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 106.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 362.13657 |
| Heavy Atoms | 26 |
| Complexity | 650.0 |
Chemical Identifiers
| CAS Number | 20086-07-1 |
|---|---|
| SMILES | C[C@@]12C[C@@H](OC13C[C@@H]([C@H]4[C@H]2C[C@H](C[C@H]4C(=O)O)O)OC3=O)C5=COC=C5 |
| InChIKey | UYALWPKCIMKALF-XBHMPIGQSA-N |
Product Overview
Diosbulbin C (CAS 20086-07-1), with molecular formula C19H22O7 and molecular weight 362.14 g/mol. IUPAC: (3R,5S,6R,8R,10R,11S,12S)-3-(furan-3-yl)-8-hydroxy-5-methyl-14-oxo-2,13-dioxatetracyclo[10.2.1.01,5.06,11]pentadecane-10-carboxylic acid.
Chemical Property Profile of Diosbulbin C
Property Insights of Diosbulbin C
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diosbulbin C. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Diosbulbin C. Following Lipinski's Rule of Five, Diosbulbin C has 2 hydrogen bond donor(s) and 7 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 Diosbulbin C?
The CAS number of Diosbulbin C is 20086-07-1.
What is the molecular formula of Diosbulbin C?
The molecular formula of Diosbulbin C is C19H22O7.
What is the molecular weight of Diosbulbin C?
The molecular weight of Diosbulbin C is 362.14 g/mol.
Where can I buy Diosbulbin C?
You can request a quote for Diosbulbin C directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diosbulbin C?
Yes, KEHONG BIO provides custom synthesis services for Diosbulbin C and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.