Deoxymorellin
TL;DR: Deoxymorellin (CAS 1064-34-2) is a chemical compound with molecular formula C33H38O6 and molecular weight 530.26685 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
12-hydroxy-8,8,21,21-tetramethyl-5,19-bis(3-methylbut-2-enyl)-3,7,20-trioxahexacyclo[15.4.1.02,15.02,19.04,13.06,11]docosa-4(13),5,9,11,15-pentaene-14,18-dione
Also Known As: Deoxymorellin, Desoxymorellin, Morellin, deoxy-, 12-hydroxy-8,8,21,21-tetramethyl-5,19-bis(3-methylbut-2-enyl)-3,7,20-trioxahexacyclo[15.4.1.02,15.02,19.04,13.06,11]docosa-4(13),5,9,11,15-pentaene-14,18-dione, 1,5-Methano-1H,7H,11H-furo[3,4-g]pyrano[3,2-b]xanthene-7,15-dione, 3,3a,4,5-tetrahydro-8-hydroxy-3,3,11,11-tetramethyl-1,13-bis(3-methyl-2-buten-1-yl)-, (1R,3aS,5S,14aS)-
Technical Specifications
| Molecular Formula | C33H38O6 |
| Molecular Weight | 530.26685 g/mol |
| XLogP | 6.7 |
| Topological Polar Surface Area (TPSA) | 82.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 530.26685 Da |
| Heavy Atoms | 39 |
| Complexity | 1230.0 |
| SMILES | CC(=CCC1=C2C(=C(C3=C1OC45C6CC(C=C4C3=O)C(=O)C5(OC6(C)C)CC=C(C)C)O)C=CC(O2)(C)C)C |
| InChIKey | VZQQLPACAVHZQT-UHFFFAOYSA-N |
Chemical Property Profile of Deoxymorellin
Property Insights of Deoxymorellin
The XLogP value of 6.7 indicates that Deoxymorellin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Deoxymorellin. Following Lipinski's Rule of Five, Deoxymorellin has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Deoxymorellin?
The CAS number of Deoxymorellin is 1064-34-2.
What is the molecular formula of Deoxymorellin?
The molecular formula of Deoxymorellin is C33H38O6.
What is the molecular weight of Deoxymorellin?
The molecular weight of Deoxymorellin is 530.26685 g/mol.
Where can I buy Deoxymorellin?
You can request a quote for Deoxymorellin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Deoxymorellin?
Yes, CoreyChem provides custom synthesis services for Deoxymorellin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.