藤黄果素
TL;DR: 藤黄果素 (CAS 78824-30-3) is a chemical compound with molecular formula C38H50O6 and molecular weight 602.36 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
藤黄果素
3-[(3,4-dihydroxyphenyl)-hydroxymethylidene]-6,6-dimethyl-5,7-bis(3-methylbut-2-enyl)-1-(5-methyl-2-prop-1-en-2-ylhex-4-enyl)bicyclo[3.3.1]nonane-2,4,9-trione
Also Known As: Garcinol, Camboginol, (1R,3Z,5S,7S)-3-[(3,4-dihydroxyphenyl)-hydroxymethylidene]-6,6-dimethyl-5,7-bis(3-methylbut-2-enyl)-1-[(2R)-5-methyl-2-prop-1-en-2-ylhex-4-enyl]bicyclo[3.3.1]nonane-2,4,9-trione, 3-(3,4-dihydroxybenzoyl)-4-hydroxy-8,8-dimethyl-5-[5-methyl-2-(prop-1-en-2-yl)hex-4-en-1-yl]-1,7-bis(3-methylbut-2-en-1-yl)bicyclo[3.3.1]non-3-ene-2,9-dione, 3-[(3,4-dihydroxyphenyl)(hydroxy)methylidene]-6,6-dimethyl-5,7-bis(3-methylbut-2-en-1-yl)-1-[5-methyl-2-(prop-1-en-2-yl)hex-4-en-1-yl]bicyclo[3.3.1]nonane-2,4,9-trione
| Molecular Formula | C38H50O6 |
|---|---|
| Molecular Weight | 602.36 g/mol |
| LogP | 10.3 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 602.3607 |
| Heavy Atoms | 44 |
| Complexity | 1300.0 |
Chemical Identifiers
| CAS Number | 78824-30-3 |
|---|---|
| SMILES | CC(=CCC1CC2(C(=O)C(=C(C3=CC(=C(C=C3)O)O)O)C(=O)C(C2=O)(C1(C)C)CC=C(C)C)CC(CC=C(C)C)C(=C)C)C |
| InChIKey | DTTONLKLWRTCAB-UHFFFAOYSA-N |
Product Overview
藤黄果素 (CAS 78824-30-3), with molecular formula C38H50O6 and molecular weight 602.36 g/mol. IUPAC: 3-[(3,4-dihydroxyphenyl)-hydroxymethylidene]-6,6-dimethyl-5,7-bis(3-methylbut-2-enyl)-1-(5-methyl-2-prop-1-en-2-ylhex-4-enyl)bicyclo[3.3.1]nonane-2,4,9-trione.
Chemical Property Profile of 藤黄果素
Property Insights of 藤黄果素
The XLogP value of 10.3 indicates that 山竹醇 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 藤黄果素. Following Lipinski's Rule of Five, 山竹醇 has 3 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 山竹醇?
The CAS number of 山竹醇 is 78824-30-3.
What is the molecular formula of 山竹醇?
The molecular formula of 山竹醇 is C38H50O6.
What is the molecular weight of 山竹醇?
The molecular weight of 山竹醇 is 602.36 g/mol.
Where can I buy 山竹醇?
You can request a quote for 山竹醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 山竹醇?
Yes, KEHONG BIO provides custom synthesis services for 山竹醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.