TL;DR: Haedoxan (CAS 123619-26-1) is a chemical compound with molecular formula C33H34O14 and molecular weight 654.1949 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3R,3aS,6S,6aR)-6-[(2R,3R)-3-(1,3-benzodioxol-5-yl)-6-methoxy-2-(methoxymethyl)-2,3-dihydro-1,4-benzodioxin-7-yl]-3-[(4,6-dimethoxy-1,3-benzodioxol-5-yl)oxy]-3,4,6,6a-tetrahydro-1H-furo[3,4-c]furan-3a-ol
Also Known As: Haedoxan, Haedoxan A, ( )-Haedoxan, (+)-Haedoxan, (+)-HAEDOXAN A
| Molecular Formula | C33H34O14 |
| Molecular Weight | 654.1949 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 140.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 9 |
| Exact Mass | 654.1949 Da |
| Heavy Atoms | 47 |
| Complexity | 1070.0 |
| SMILES | COC[C@@H]1[C@H](OC2=C(O1)C=C(C(=C2)OC)[C@@H]3[C@H]4CO[C@@H]([C@]4(CO3)O)OC5=C(C=C6C(=C5OC)OCO6)OC)C7=CC8=C(C=C7)OCO8 |
| InChIKey | SVQIUEXUTJVJTM-KTIWSMOXSA-N |
The XLogP value of 3.0 indicates that Haedoxan is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 140.0 Ų indicates high polarity, suggesting Haedoxan may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Haedoxan has 1 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Haedoxan is 123619-26-1.
The molecular formula of Haedoxan is C33H34O14.
The molecular weight of Haedoxan is 654.1949 g/mol.
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