TL;DR: Oxofangchirine (CAS 102516-53-0) is a chemical compound with molecular formula C37H34N2O7 and molecular weight 618.2366 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
9,20,21,25-tetramethoxy-15-methyl-7,23-dioxa-15,30-diazaheptacyclo[22.6.2.23,6.18,12.114,18.027,31.022,33]hexatriaconta-1(30),3(36),4,6(35),8,10,12(34),18,20,22(33),24,26,28,31-tetradecaen-2-one
Also Known As: Oxofangchirine, J2.411.921A, 6,6',7,12-tetramethoxy-2-methyl-1',2',3',4'-tetradehydroberbaman-15'-one, 9,20,21,25-tetramethoxy-15-methyl-7,23-dioxa-15,30-diazaheptacyclo[22.6.2.23,6.18,12.114,18.027,31.022,33]hexatriaconta-1(30),3(36),4,6(35),8,10,12(34),18,20,22(33),24,26,28,31-tetradecaen-2-one, 16a,17,18,19-Tetrahydro-12,21,22,26-tetramethoxy-17-methyl-16H-1,24:6,9-dietheno-11,15-metheno-5H-pyrido[2 ,3 :17,18][1,11]dioxacycloicosino[2,3,4-ij]isoquinoline-5-one
| Molecular Formula | C37H34N2O7 |
| Molecular Weight | 618.2366 g/mol |
| XLogP | 6.8 |
| Topological Polar Surface Area (TPSA) | 88.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 618.2366 Da |
| Heavy Atoms | 46 |
| Complexity | 1020.0 |
| SMILES | CN1CCC2=CC(=C(C3=C2C1CC4=CC(=C(C=C4)OC)OC5=CC=C(C=C5)C(=O)C6=NC=CC7=CC(=C(O3)C=C76)OC)OC)OC |
| InChIKey | INUHRHLZFLIFNB-UHFFFAOYSA-N |
The XLogP value of 6.8 indicates that Oxofangchirine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Oxofangchirine. Following Lipinski's Rule of Five, Oxofangchirine has 0 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Oxofangchirine is 102516-53-0.
The molecular formula of Oxofangchirine is C37H34N2O7.
The molecular weight of Oxofangchirine is 618.2366 g/mol.
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