TL;DR: Guttiferone A (CAS 147687-34-1) is a chemical compound with molecular formula C38H50O6 and molecular weight 602.3607 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[(3,4-dihydroxyphenyl)-hydroxymethylidene]-6-methyl-1,5,7-tris(3-methylbut-2-enyl)-6-(4-methylpent-3-enyl)bicyclo[3.3.1]nonane-2,4,9-trione
Also Known As: Guttiferone A, 3-[(3,4-dihydroxyphenyl)(hydroxy)methylidene]-6-methyl-1,5,7-tris(3-methylbut-2-en-1-yl)-6-(4-methylpent-3-en-1-yl)bicyclo[3.3.1]nonane-2,4,9-trione, 3-[(3,4-dihydroxyphenyl)-hydroxymethylidene]-6-methyl-1,5,7-tris(3-methylbut-2-enyl)-6-(4-methylpent-3-enyl)bicyclo[3.3.1]nonane-2,4,9-trione
| Molecular Formula | C38H50O6 |
| Molecular Weight | 602.3607 g/mol |
| XLogP | 10.4 |
| Topological Polar Surface Area (TPSA) | 112.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 602.3607 Da |
| Heavy Atoms | 44 |
| Complexity | 1290.0 |
| SMILES | CC(=CCCC1(C(CC2(C(=O)C(=C(C3=CC(=C(C=C3)O)O)O)C(=O)C1(C2=O)CC=C(C)C)CC=C(C)C)CC=C(C)C)C)C |
| InChIKey | SHBMQWRFQJLYJU-UHFFFAOYSA-N |
The XLogP value of 10.4 indicates that Guttiferone A 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 Guttiferone A. Following Lipinski's Rule of Five, Guttiferone A has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Guttiferone A is 147687-34-1.
The molecular formula of Guttiferone A is C38H50O6.
The molecular weight of Guttiferone A is 602.3607 g/mol.
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