Macrocarpal D
TL;DR: Macrocarpal D (CAS 327622-65-1) is a chemical compound with molecular formula C28H40O6 and molecular weight 472.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4,6-trihydroxy-5-[1-[7-(2-hydroxypropan-2-yl)-1,4-dimethyl-3,3a,4,5,6,7-hexahydro-2H-azulen-1-yl]-3-methylbutyl]benzene-1,3-dicarbaldehyde
Also Known As: Macrocarpal D, Macrocarpal O, 4CN-0282, 2,4,6-trihydroxy-5-[1-[7-(2-hydroxypropan-2-yl)-1,4-dimethyl-3,3a,4,5,6,7-hexahydro-2H-azulen-1-yl]-3-methylbutyl]benzene-1,3-dicarbaldehyde, 2,4,6-trihydroxy-5-(1-(5-(1-hydroxy-isopropyl)-2,8-dimethylbicyclo(5.3.0)dec-6-en-8-yl)-3-methylbutyl)benzene-1,3-dicarbaldehyde
| Molecular Formula | C28H40O6 |
|---|---|
| Molecular Weight | 472.28 g/mol |
| LogP | 6.2 |
| Topological Polar Surface Area | 115.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 472.2825 |
| Heavy Atoms | 34 |
| Complexity | 753.0 |
Chemical Identifiers
| CAS Number | 327622-65-1 |
|---|---|
| SMILES | CC1CCC(C=C2C1CCC2(C)C(CC(C)C)C3=C(C(=C(C(=C3O)C=O)O)C=O)O)C(C)(C)O |
| InChIKey | VUKIJLQDSQXHDI-UHFFFAOYSA-N |
Product Overview
Macrocarpal D (CAS 327622-65-1), with molecular formula C28H40O6 and molecular weight 472.28 g/mol. IUPAC: 2,4,6-trihydroxy-5-[1-[7-(2-hydroxypropan-2-yl)-1,4-dimethyl-3,3a,4,5,6,7-hexahydro-2H-azulen-1-yl]-3-methylbutyl]benzene-1,3-dicarbaldehyde.
Chemical Property Profile of Macrocarpal D
Property Insights of Macrocarpal D
The XLogP value of 6.2 indicates that Macrocarpal D is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Macrocarpal D. Following Lipinski's Rule of Five, Macrocarpal D has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Macrocarpal D?
The CAS number of Macrocarpal D is 327622-65-1.
What is the molecular formula of Macrocarpal D?
The molecular formula of Macrocarpal D is C28H40O6.
What is the molecular weight of Macrocarpal D?
The molecular weight of Macrocarpal D is 472.28 g/mol.
Where can I buy Macrocarpal D?
You can request a quote for Macrocarpal D directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Macrocarpal D?
Yes, KEHONG BIO provides custom synthesis services for Macrocarpal D and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.