异红厚壳酸
TL;DR: 异红厚壳酸 (CAS 157810-76-9) is a chemical compound with molecular formula C25H24O6 and molecular weight 420.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
异红厚壳酸
(Z)-3-[(2R,3S)-5-hydroxy-2,3,8,8-tetramethyl-4-oxo-2,3-dihydropyrano[2,3-h]chromen-6-yl]-3-phenylprop-2-enoic acid
Also Known As: Isocalophyllic acid, Calophyllic acid, SSJOJPHKKKSPGS-ALRNZDJHSA-, (Z)-3-[(2R,3S)-5-hydroxy-2,3,8,8-tetramethyl-4-oxo-2,3-dihydropyrano[2,3-h]chromen-6-yl]-3-phenylprop-2-enoic acid, 3-(5-Hydroxy-2,3,8,8-tetramethyl-4-oxo-3,4-dihydro-2H,8H-pyrano[2,3-f]chromen-6-yl)-3-phenyl-acrylic acid
| Molecular Formula | C25H24O6 |
|---|---|
| Molecular Weight | 420.16 g/mol |
| LogP | 4.6924 |
| Topological Polar Surface Area | 93.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 420.1573 |
| Heavy Atoms | 31 |
| Complexity | 1140.5924 |
Chemical Identifiers
| CAS Number | 157810-76-9 |
|---|---|
| SMILES | C[C@H]1[C@H](OC2=C3C=CC(OC3=C(C(=C2C1=O)O)/C(=C\C(=O)O)/C4=CC=CC=C4)(C)C)C |
Product Overview
异红厚壳酸 (CAS 157810-76-9), with molecular formula C25H24O6 and molecular weight 420.16 g/mol. IUPAC: (Z)-3-[(2R,3S)-5-hydroxy-2,3,8,8-tetramethyl-4-oxo-2,3-dihydropyrano[2,3-h]chromen-6-yl]-3-phenylprop-2-enoic acid.
Chemical Property Profile of 异红厚壳酸
Property Insights of 异红厚壳酸
The XLogP value of 4.6924 indicates that 异红厚壳酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 异红厚壳酸. Following Lipinski's Rule of Five, 异红厚壳酸 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 异红厚壳酸?
The CAS number of 异红厚壳酸 is 157810-76-9.
What is the molecular formula of 异红厚壳酸?
The molecular formula of 异红厚壳酸 is C25H24O6.
What is the molecular weight of 异红厚壳酸?
The molecular weight of 异红厚壳酸 is 420.16 g/mol.
Where can I buy 异红厚壳酸?
You can request a quote for 异红厚壳酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 异红厚壳酸?
Yes, KEHONG BIO provides custom synthesis services for 异红厚壳酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.