mollicellin B
TL;DR: mollicellin B (CAS 68455-07-2) is a chemical compound with molecular formula C21H18O7 and molecular weight 382.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-hydroxy-2,2,5,8-tetramethyl-4,7-dioxo-3H-chromeno[7,6-b][1,4]benzodioxepine-11-carbaldehyde
Also Known As: mollicellin B, Mollicelline B, J2.770.216C, 10-hydroxy-2,2,5,8-tetramethyl-4,7-dioxo-3H-chromeno[7,6-b][1,4]benzodioxepine-11-carbaldehyde, 2H,7H-1-Benzopyrano(7,6-b)(1,4)benzodioxepin-11-carboxaldehyde, 3,4-dihydro-10-hydroxy-2,2,5,8-tetramethyl-4,7-dioxo-
| Molecular Formula | C21H18O7 |
|---|---|
| Molecular Weight | 382.11 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 99.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 382.10526 |
| Heavy Atoms | 28 |
| Complexity | 674.0 |
Chemical Identifiers
| CAS Number | 68455-07-2 |
|---|---|
| SMILES | CC1=CC(=C(C2=C1C(=O)OC3=C(O2)C=C4C(=C3C)C(=O)CC(O4)(C)C)C=O)O |
| InChIKey | OMOOHFQAZTVBPK-UHFFFAOYSA-N |
Product Overview
mollicellin B (CAS 68455-07-2), with molecular formula C21H18O7 and molecular weight 382.11 g/mol. IUPAC: 10-hydroxy-2,2,5,8-tetramethyl-4,7-dioxo-3H-chromeno[7,6-b][1,4]benzodioxepine-11-carbaldehyde.
Chemical Property Profile of mollicellin B
Property Insights of mollicellin B
The XLogP value of 3.4 indicates that mollicellin B is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.1 Ų falls within the moderate polarity range, balancing permeability and solubility for mollicellin B. Following Lipinski's Rule of Five, mollicellin B has 1 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 mollicellin B?
The CAS number of mollicellin B is 68455-07-2.
What is the molecular formula of mollicellin B?
The molecular formula of mollicellin B is C21H18O7.
What is the molecular weight of mollicellin B?
The molecular weight of mollicellin B is 382.11 g/mol.
Where can I buy mollicellin B?
You can request a quote for mollicellin B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for mollicellin B?
Yes, KEHONG BIO provides custom synthesis services for mollicellin B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.