Carapin
TL;DR: Carapin (CAS 3463-88-5) is a chemical compound with molecular formula C27H32O7 and molecular weight 468.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[6-(furan-3-yl)-1,5,15,15-tetramethyl-8,14,17-trioxo-7-oxatetracyclo[11.3.1.02,11.05,10]heptadec-9-en-16-yl]acetate
Also Known As: Carapin, KBio2_000970, 7,11-Methano-2H-cycloocta[f][2]benzopyran-8-aceticacid,4-(3-furanyl)-4,4a,5,6,6a,7,8,9,10,11,12,12a-dodecahydro-4a,7,9,9-tetramethyl-2,10,13-trioxo-,methyl ester, (4R,4aR,7S,8S,11S)-, Methyl 2-[6-(furan-3-yl)-1,5,15,15-tetramethyl-8,14,17-trioxo-7-oxatetracyclo[11.3.1.02,11.05,10]heptadec-9-en-16-yl]acetate, 4-(3-Furyl)-4,4a,5,6,6a,7,8,9,10,11,12,12a-dodecahydro-4a,7,9,9-tetramethyl-2,10,13-trioxo-7,11-methano-2H-cycloocta[f][2]benzopyran-8-acetic acid methyl ester
| Molecular Formula | C27H32O7 |
|---|---|
| Molecular Weight | 468.21 g/mol |
| LogP | 4.2199 |
| Topological Polar Surface Area | 99.88 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 468.2148 |
| Heavy Atoms | 34 |
| Complexity | 1096.2208 |
Chemical Identifiers
| CAS Number | 3463-88-5 |
|---|---|
| SMILES | CC1(C(C2(C3CCC4(C(OC(=O)C=C4C3CC(C1=O)C2=O)C5=COC=C5)C)C)CC(=O)OC)C |
Product Overview
Carapin (CAS 3463-88-5), with molecular formula C27H32O7 and molecular weight 468.21 g/mol. IUPAC: methyl 2-[6-(furan-3-yl)-1,5,15,15-tetramethyl-8,14,17-trioxo-7-oxatetracyclo[11.3.1.02,11.05,10]heptadec-9-en-16-yl]acetate.
Chemical Property Profile of Carapin
Property Insights of Carapin
The XLogP value of 4.2199 indicates that Carapin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.88 Ų falls within the moderate polarity range, balancing permeability and solubility for Carapin. Following Lipinski's Rule of Five, Carapin has 0 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 Carapin?
The CAS number of Carapin is 3463-88-5.
What is the molecular formula of Carapin?
The molecular formula of Carapin is C27H32O7.
What is the molecular weight of Carapin?
The molecular weight of Carapin is 468.21 g/mol.
Where can I buy Carapin?
You can request a quote for Carapin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carapin?
Yes, KEHONG BIO provides custom synthesis services for Carapin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.