(2R,5S,7'R)-5-(Furan-3-yl)-2-hydroxy-7'-methyl-3',4,5,5',5a',7',8',8a'-octahydrospiro(furan-3,6'-naphtho(1,8-bc)furan)-2'(4'H)-one
TL;DR: (2R,5S,7'R)-5-(Furan-3-yl)-2-hydroxy-7'-methyl-3',4,5,5',5a',7',8',8a'-octahydrospiro(furan-3,6'-naphtho(1,8-bc)furan)-2'(4'H)-one (CAS 136176-66-4) is a chemical compound with molecular formula C19H22O5 and molecular weight 330.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2'R,5'S,10R)-5'-(furan-3-yl)-2'-hydroxy-10-methylspiro[2-oxatricyclo[6.3.1.04,12]dodec-4(12)-ene-9,3'-oxolane]-3-one
Also Known As: (2R,5S,7'R)-5-(Furan-3-yl)-2-hydroxy-7'-methyl-3',4,5,5',5a',7',8',8a'-octahydrospiro(furan-3,6'-naphtho(1,8-bc)furan)-2'(4'H)-one, (2'R,5'S,7R)-5'-(Furan-3-yl)-2'-hydroxy-7-methyl-3,5,5a,7,8,8a-hexahydrospiro[naphtho[1,8-bc]furan-6,3'-oxolan]-2(4H)-one, 5'-(Furan-3-yl)-2'-hydroxy-7-methyl-3,5,5a,7,8,8a-hexahydrospiro[naphtho[1,8-bc]furan-6,3'-oxolan]-2(4H)-one
| Molecular Formula | C19H22O5 |
|---|---|
| Molecular Weight | 330.15 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 68.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 330.14673 |
| Heavy Atoms | 24 |
| Complexity | 599.0 |
Chemical Identifiers
| CAS Number | 136176-66-4 |
|---|---|
| SMILES | C[C@@H]1CC2C3=C(CCCC3C14C[C@H](O[C@H]4O)C5=COC=C5)C(=O)O2 |
| InChIKey | UUKKEAFOECOLNR-COYGVGIDSA-N |
Product Overview
(2R,5S,7'R)-5-(Furan-3-yl)-2-hydroxy-7'-methyl-3',4,5,5',5a',7',8',8a'-octahydrospiro(furan-3,6'-naphtho(1,8-bc)furan)-2'(4'H)-one (CAS 136176-66-4), with molecular formula C19H22O5 and molecular weight 330.15 g/mol. IUPAC: (2'R,5'S,10R)-5'-(furan-3-yl)-2'-hydroxy-10-methylspiro[2-oxatricyclo[6.3.1.04,12]dodec-4(12)-ene-9,3'-oxolane]-3-one.
Chemical Property Profile of (2R,5S,7'R)-5-(Furan-3-yl)-2-hydroxy-7'-methyl-3',4,5,5',5a',7',8',8a'-octahydrospiro(furan-3,6'-naphtho(1,8-bc)furan)-2'(4'H)-one
Property Insights of (2R,5S,7'R)-5-(Furan-3-yl)-2-hydroxy-7'-methyl-3',4,5,5',5a',7',8',8a'-octahydrospiro(furan-3,6'-naphtho(1,8-bc)furan)-2'(4'H)-one
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2R,5S,7'R)-5-(Furan-3-yl)-2-hydroxy-7'-methyl-3',4,5,5',5a',7',8',8a'-octahydrospiro(furan-3,6'-naphtho(1,8-bc)furan)-2'(4'H)-one. The TPSA of 68.9 Ų falls within the moderate polarity range, balancing permeability and solubility for (2R,5S,7'R)-5-(Furan-3-yl)-2-hydroxy-7'-methyl-3',4,5,5',5a',7',8',8a'-octahydrospiro(furan-3,6'-naphtho(1,8-bc)furan)-2'(4'H)-one. Following Lipinski's Rule of Five, (2R,5S,7'R)-5-(Furan-3-yl)-2-hydroxy-7'-methyl-3',4,5,5',5a',7',8',8a'-octahydrospiro(furan-3,6'-naphtho(1,8-bc)furan)-2'(4'H)-one has 1 hydrogen bond donor(s) and 5 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 (2R,5S,7'R)-5-(Furan-3-yl)-2-hydroxy-7'-methyl-3',4,5,5',5a',7',8',8a'-octahydrospiro(furan-3,6'-naphtho(1,8-bc)furan)-2'(4'H)-one?
The CAS number of (2R,5S,7'R)-5-(Furan-3-yl)-2-hydroxy-7'-methyl-3',4,5,5',5a',7',8',8a'-octahydrospiro(furan-3,6'-naphtho(1,8-bc)furan)-2'(4'H)-one is 136176-66-4.
What is the molecular formula of (2R,5S,7'R)-5-(Furan-3-yl)-2-hydroxy-7'-methyl-3',4,5,5',5a',7',8',8a'-octahydrospiro(furan-3,6'-naphtho(1,8-bc)furan)-2'(4'H)-one?
The molecular formula of (2R,5S,7'R)-5-(Furan-3-yl)-2-hydroxy-7'-methyl-3',4,5,5',5a',7',8',8a'-octahydrospiro(furan-3,6'-naphtho(1,8-bc)furan)-2'(4'H)-one is C19H22O5.
What is the molecular weight of (2R,5S,7'R)-5-(Furan-3-yl)-2-hydroxy-7'-methyl-3',4,5,5',5a',7',8',8a'-octahydrospiro(furan-3,6'-naphtho(1,8-bc)furan)-2'(4'H)-one?
The molecular weight of (2R,5S,7'R)-5-(Furan-3-yl)-2-hydroxy-7'-methyl-3',4,5,5',5a',7',8',8a'-octahydrospiro(furan-3,6'-naphtho(1,8-bc)furan)-2'(4'H)-one is 330.15 g/mol.
Where can I buy (2R,5S,7'R)-5-(Furan-3-yl)-2-hydroxy-7'-methyl-3',4,5,5',5a',7',8',8a'-octahydrospiro(furan-3,6'-naphtho(1,8-bc)furan)-2'(4'H)-one?
You can request a quote for (2R,5S,7'R)-5-(Furan-3-yl)-2-hydroxy-7'-methyl-3',4,5,5',5a',7',8',8a'-octahydrospiro(furan-3,6'-naphtho(1,8-bc)furan)-2'(4'H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2R,5S,7'R)-5-(Furan-3-yl)-2-hydroxy-7'-methyl-3',4,5,5',5a',7',8',8a'-octahydrospiro(furan-3,6'-naphtho(1,8-bc)furan)-2'(4'H)-one?
Yes, KEHONG BIO provides custom synthesis services for (2R,5S,7'R)-5-(Furan-3-yl)-2-hydroxy-7'-methyl-3',4,5,5',5a',7',8',8a'-octahydrospiro(furan-3,6'-naphtho(1,8-bc)furan)-2'(4'H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.