TL;DR: Chaetoviridin B (CAS 128230-03-5) is a chemical compound with molecular formula C24H31ClO6 and molecular weight 450.1809 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(6aS)-9-acetyl-5-chloro-8-hydroxy-8-(3-hydroxybutan-2-yl)-6a-methyl-3-[(E,3S)-3-methylpent-1-enyl]-9,9a-dihydrofuro[2,3-h]isochromen-6-one
Also Known As: Chaetoviridin B, 6H-Furo(2,3-h)-2-benzopyran-9-carboxylic acid, 5-chloro-6a,8,9,9a-tetrahydro-8-hydroxy-8-(2-hydroxy-1-methylpropyl)-6a-methyl-3-(3-methyl-1-pentenyl)-6-oxo, (6aS)-9-acetyl-5-chloro-8-hydroxy-8-(2-hydroxy-1-methyl-propyl)-6a-methyl-3-[(E,3S)-3-methylpent-1-enyl]-9,9a-dihydrofuro[2,3-h]isochromen-6-one, (6aS)-9-acetyl-5-chloro-8-hydroxy-8-(3-hydroxybutan-2-yl)-6a-methyl-3-[(E,3S)-3-methylpent-1-enyl]-9,9a-dihydrofuro[2,3-h]isochromen-6-one, 6H-Furo[2,3-h]-2-benzopyran-9-carboxylic acid, 5-chloro-6a,8,9,9a-tetrahydro-8-hydroxy-8-(2-hydroxy-1-methylpropyl)-6a-methyl-3-(3-methyl-1-pentenyl)-6-oxo
| Molecular Formula | C24H31ClO6 |
| Molecular Weight | 450.1809 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 93.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 450.1809 Da |
| Heavy Atoms | 31 |
| Complexity | 915.0 |
| SMILES | CC[C@H](C)/C=C/C1=CC2=C(C(=O)[C@@]3(C(C2=CO1)C(C(O3)(C(C)C(C)O)O)C(=O)C)C)Cl |
| InChIKey | FVQFDNWSJTWBCG-HSYIISPWSA-N |
The XLogP value of 3.2 indicates that Chaetoviridin B is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Chaetoviridin B. Following Lipinski's Rule of Five, Chaetoviridin B has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Chaetoviridin B is 128230-03-5.
The molecular formula of Chaetoviridin B is C24H31ClO6.
The molecular weight of Chaetoviridin B is 450.1809 g/mol.
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