Phrymarolin I
TL;DR: Phrymarolin I (CAS 38303-95-6) is a chemical compound with molecular formula C24H24O11 and molecular weight 488.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3S,3aS,6S,6aR)-6-(6-methoxy-1,3-benzodioxol-5-yl)-3-[(6-methoxy-1,3-benzodioxol-5-yl)oxy]-3,4,6,6a-tetrahydro-1H-furo[3,4-c]furan-3a-yl] acetate
Also Known As: Phrymarolin I, J2.783.594E, [(3S,3aS,6S,6aR)-6-(6-methoxy-1,3-benzodioxol-5-yl)-3-[(6-methoxy-1,3-benzodioxol-5-yl)oxy]-3,4,6,6a-tetrahydro-1H-furo[3,4-c]furan-3a-yl] acetate, ((3S,3aS,6S,6aR)-6-(6-methoxy-1,3-benzodioxol-5-yl)-3-((6-methoxy-1,3-benzodioxol-5-yl)oxy)-3,4,6,6a-tetrahydro-1H-furo(3,4-c)furan-3a-yl) acetate, (1S,3aS,4S,6aR)-1-(6-methoxy-2H-1,3-benzodioxol-5-yl)-4-[(6-methoxy-2H-1,3-benzodioxol-5-yl)oxy]-hexahydrofuro[3,4-c]furan-3a-yl acetate
| Molecular Formula | C24H24O11 |
|---|---|
| Molecular Weight | 488.13 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 7 |
| Exact Mass | 488.13187 |
| Heavy Atoms | 35 |
| Complexity | 781.0 |
Chemical Identifiers
| CAS Number | 38303-95-6 |
|---|---|
| SMILES | CC(=O)O[C@]12CO[C@@H]([C@H]1CO[C@H]2OC3=C(C=C4C(=C3)OCO4)OC)C5=CC6=C(C=C5OC)OCO6 |
| InChIKey | ZGBQEJGNORPNKC-PDLWQGAHSA-N |
Product Overview
Phrymarolin I (CAS 38303-95-6), with molecular formula C24H24O11 and molecular weight 488.13 g/mol. IUPAC: [(3S,3aS,6S,6aR)-6-(6-methoxy-1,3-benzodioxol-5-yl)-3-[(6-methoxy-1,3-benzodioxol-5-yl)oxy]-3,4,6,6a-tetrahydro-1H-furo[3,4-c]furan-3a-yl] acetate.
Chemical Property Profile of Phrymarolin I
Property Insights of Phrymarolin I
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phrymarolin I. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Phrymarolin I. Following Lipinski's Rule of Five, Phrymarolin I has 0 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Phrymarolin I?
The CAS number of Phrymarolin I is 38303-95-6.
What is the molecular formula of Phrymarolin I?
The molecular formula of Phrymarolin I is C24H24O11.
What is the molecular weight of Phrymarolin I?
The molecular weight of Phrymarolin I is 488.13 g/mol.
Where can I buy Phrymarolin I?
You can request a quote for Phrymarolin I directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phrymarolin I?
Yes, KEHONG BIO provides custom synthesis services for Phrymarolin I and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.