![(3S,7R)-7,14-dihydroxy-16-methoxy-3-methyl-3,4,5,6,7,8,9,10,11,12-decahydro-1H-benzo[c][1]oxacyclotetradecin-1-one structure](/static/products/121/1212085-77-2.png)
(3S,7R)-7,14-dihydroxy-16-methoxy-3-methyl-3,4,5,6,7,8,9,10,11,12-decahydro-1H-benzo[c][1]oxacyclotetradecin-1-one
TL;DR: (3S,7R)-7,14-dihydroxy-16-methoxy-3-methyl-3,4,5,6,7,8,9,10,11,12-decahydro-1H-benzo[c][1]oxacyclotetradecin-1-one (CAS 1212085-77-2) is a chemical compound with molecular formula C19H28O5 and molecular weight 336.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4S,8R)-8,16-dihydroxy-18-methoxy-4-methyl-3-oxabicyclo[12.4.0]octadeca-1(14),15,17-trien-2-one
Also Known As: (3S,7R)-7,14-dihydroxy-16-methoxy-3-methyl-3,4,5,6,7,8,9,10,11,12-decahydro-1H-benzo[c][1]oxacyclotetradecin-1-one, (7R,11S)-7,17-dihydroxy-15-methoxy-11-methyl-12-oxabicyclo[12.4.0]octadeca-1(14),15,17-trien-13-one
| Molecular Formula | C19H28O5 |
|---|---|
| Molecular Weight | 336.19 g/mol |
| LogP | 3.5938 |
| Topological Polar Surface Area | 75.99 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 336.19366 |
| Heavy Atoms | 24 |
| Complexity | 554.9333 |
Chemical Identifiers
| CAS Number | 1212085-77-2 |
|---|---|
| SMILES | C[C@H]1CCC[C@@H](CCCCCC2=C(C(=CC(=C2)O)OC)C(=O)O1)O |
Product Overview
(3S,7R)-7,14-dihydroxy-16-methoxy-3-methyl-3,4,5,6,7,8,9,10,11,12-decahydro-1H-benzo[c][1]oxacyclotetradecin-1-one (CAS 1212085-77-2), with molecular formula C19H28O5 and molecular weight 336.19 g/mol. IUPAC: (4S,8R)-8,16-dihydroxy-18-methoxy-4-methyl-3-oxabicyclo[12.4.0]octadeca-1(14),15,17-trien-2-one.
Chemical Property Profile of (3S,7R)-7,14-dihydroxy-16-methoxy-3-methyl-3,4,5,6,7,8,9,10,11,12-decahydro-1H-benzo[c][1]oxacyclotetradecin-1-one
Property Insights of (3S,7R)-7,14-dihydroxy-16-methoxy-3-methyl-3,4,5,6,7,8,9,10,11,12-decahydro-1H-benzo[c][1]oxacyclotetradecin-1-one
The XLogP value of 3.5938 indicates that (3S,7R)-7,14-dihydroxy-16-methoxy-3-methyl-3,4,5,6,7,8,9,10,11,12-decahydro-1H-benzo[c][1]oxacyclotetradecin-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.99 Ų falls within the moderate polarity range, balancing permeability and solubility for (3S,7R)-7,14-dihydroxy-16-methoxy-3-methyl-3,4,5,6,7,8,9,10,11,12-decahydro-1H-benzo[c][1]oxacyclotetradecin-1-one. Following Lipinski's Rule of Five, (3S,7R)-7,14-dihydroxy-16-methoxy-3-methyl-3,4,5,6,7,8,9,10,11,12-decahydro-1H-benzo[c][1]oxacyclotetradecin-1-one has 2 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 (3S,7R)-7,14-dihydroxy-16-methoxy-3-methyl-3,4,5,6,7,8,9,10,11,12-decahydro-1H-benzo[c][1]oxacyclotetradecin-1-one?
The CAS number of (3S,7R)-7,14-dihydroxy-16-methoxy-3-methyl-3,4,5,6,7,8,9,10,11,12-decahydro-1H-benzo[c][1]oxacyclotetradecin-1-one is 1212085-77-2.
What is the molecular formula of (3S,7R)-7,14-dihydroxy-16-methoxy-3-methyl-3,4,5,6,7,8,9,10,11,12-decahydro-1H-benzo[c][1]oxacyclotetradecin-1-one?
The molecular formula of (3S,7R)-7,14-dihydroxy-16-methoxy-3-methyl-3,4,5,6,7,8,9,10,11,12-decahydro-1H-benzo[c][1]oxacyclotetradecin-1-one is C19H28O5.
What is the molecular weight of (3S,7R)-7,14-dihydroxy-16-methoxy-3-methyl-3,4,5,6,7,8,9,10,11,12-decahydro-1H-benzo[c][1]oxacyclotetradecin-1-one?
The molecular weight of (3S,7R)-7,14-dihydroxy-16-methoxy-3-methyl-3,4,5,6,7,8,9,10,11,12-decahydro-1H-benzo[c][1]oxacyclotetradecin-1-one is 336.19 g/mol.
Where can I buy (3S,7R)-7,14-dihydroxy-16-methoxy-3-methyl-3,4,5,6,7,8,9,10,11,12-decahydro-1H-benzo[c][1]oxacyclotetradecin-1-one?
You can request a quote for (3S,7R)-7,14-dihydroxy-16-methoxy-3-methyl-3,4,5,6,7,8,9,10,11,12-decahydro-1H-benzo[c][1]oxacyclotetradecin-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3S,7R)-7,14-dihydroxy-16-methoxy-3-methyl-3,4,5,6,7,8,9,10,11,12-decahydro-1H-benzo[c][1]oxacyclotetradecin-1-one?
Yes, KEHONG BIO provides custom synthesis services for (3S,7R)-7,14-dihydroxy-16-methoxy-3-methyl-3,4,5,6,7,8,9,10,11,12-decahydro-1H-benzo[c][1]oxacyclotetradecin-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.