Montanin A
TL;DR: Montanin A (CAS 68370-49-0) is a chemical compound with molecular formula C19H20O4 and molecular weight 312.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5'S,8S,9R,10R)-5'-(furan-3-yl)-10-methylspiro[2-oxatricyclo[6.3.1.04,12]dodeca-1(12),3-diene-9,3'-oxolane]-2'-one
Also Known As: Montanin A, (5'S,8S,9R,10R)-5'-(furan-3-yl)-10-methylspiro[2-oxatricyclo[6.3.1.04,12]dodeca-1(12),3-diene-9,3'-oxolane]-2'-one, (3'R,5'S,5aS,7R)-5'-(Furan-3-yl)-7-methyl-3,4,5,5a,7,8-hexahydrospiro[naphtho[1,8-bc]furan-6,3'-oxolan]-2'-one, (3R,5S,5'aS,7'R)-5-(3-Furanyl)-3',4,4',5,5',5'a,7',8'-octahydro-7'-methylspiro(furan-3(2H),6'-(6H)naphtho(1,8-bc)furan)-2-one, (3R,5S,6'R,8'S)-5-(furan-3-yl)-6'-methyl-3'-oxaspiro[oxolane-3,7'-tricyclo[6.3.1.04,12]dodecane]-1',4'(12')-dien-2-one
| Molecular Formula | C19H20O4 |
|---|---|
| Molecular Weight | 312.14 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 312.13617 |
| Heavy Atoms | 23 |
| Complexity | 506.0 |
Chemical Identifiers
| CAS Number | 68370-49-0 |
|---|---|
| SMILES | C[C@@H]1CC2=C3[C@@H]([C@@]14C[C@H](OC4=O)C5=COC=C5)CCCC3=CO2 |
| InChIKey | CZGWUKXZLUIKBU-IUYNRSMJSA-N |
Product Overview
Montanin A (CAS 68370-49-0), with molecular formula C19H20O4 and molecular weight 312.14 g/mol. IUPAC: (5'S,8S,9R,10R)-5'-(furan-3-yl)-10-methylspiro[2-oxatricyclo[6.3.1.04,12]dodeca-1(12),3-diene-9,3'-oxolane]-2'-one.
Chemical Property Profile of Montanin A
Property Insights of Montanin A
The XLogP value of 3.4 indicates that Montanin A is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Montanin A exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Montanin A has 0 hydrogen bond donor(s) and 4 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 Montanin A?
The CAS number of Montanin A is 68370-49-0.
What is the molecular formula of Montanin A?
The molecular formula of Montanin A is C19H20O4.
What is the molecular weight of Montanin A?
The molecular weight of Montanin A is 312.14 g/mol.
Where can I buy Montanin A?
You can request a quote for Montanin A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Montanin A?
Yes, KEHONG BIO provides custom synthesis services for Montanin A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.