TL;DR: Okaramine A (CAS 115444-43-4) is a chemical compound with molecular formula C32H32N4O3 and molecular weight 520.24744 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1Z,4S,12R,14R,17Z)-12-hydroxy-19,19-dimethyl-5-(2-methylbut-3-en-2-yl)-3,5,16,21-tetrazaheptacyclo[14.13.0.03,14.04,12.06,11.020,28.022,27]nonacosa-1(29),6,8,10,17,20(28),22,24,26-nonaene-2,15-dione
Also Known As: Okaramine A, (+)-Okaramine A, ()-Okaramine A, ( )-Okaramine A, (10aR)-16-(1,1-Dimethyl-2-propenyl)-11,11a,16,16aalpha-tetrahydro-11aalpha-hydroxy-6,6-dimethyl-5H-indolo[3 ,2 :4 ,5 ]pyrrolo[1 ,2 :4 ,5 ]pyrazino[1 ,2 :1,2]azocino[5,4-b]indole-10,18(6H,10aH)-dione
| Molecular Formula | C32H32N4O3 |
| Molecular Weight | 520.24744 g/mol |
| XLogP | 4.8 |
| Topological Polar Surface Area (TPSA) | 79.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 520.24744 Da |
| Heavy Atoms | 39 |
| Complexity | 1160.0 |
| SMILES | CC1(/C=C\N2/C(=C\C3=C1NC4=CC=CC=C43)/C(=O)N5[C@@H](C2=O)C[C@@]6([C@H]5N(C7=CC=CC=C76)C(C)(C)C=C)O)C |
| InChIKey | XOYCJCSLHCTYSV-HTFKTHENSA-N |
The XLogP value of 4.8 indicates that Okaramine A is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Okaramine A. Following Lipinski's Rule of Five, Okaramine A has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Okaramine A is 115444-43-4.
The molecular formula of Okaramine A is C32H32N4O3.
The molecular weight of Okaramine A is 520.24744 g/mol.
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