Lythranidine, (+-)-
23-methoxy-25-azatetracyclo[18.3.1.12,6.111,15]hexacosa-1(23),2,4,6(26),20(24),21-hexaene-3,9,17-triol
Also Known As: Lythranidine|(+-)-Lythranidine|( )-Lythranidine|Lythranidine, (+-)-|(Z)-non-4-en-2-yne|4-Nonen-2-yne, (E)-|J3.042.130B|23-Methoxy-25-azatetracyclo[18.3.1.12,6.111,15]hexacosa-1(23),2,4,6(26),20(24),21-hexaene-3,9,17-triol|23-methoxy-25-azatetracyclo(18.3.1.12,6.111,15)hexacosa-1(23),2,4,6(26),20(24),21-hexaene-3,9,17-triol|23-methoxy-25-azatetracyclo[18.3.1.12,6.111,15]hexacosa-1(24),2(26),3,5,20,22-hexaene-3,9,17-triol|23-Methoxy-25-azatetracyclo[18.3.1.12,6.111,15]hexacosa-1(24),2,4,6(26),20,22-hexaene-3,9,17-triol
| Molecular Formula | C26H35NO4 |
|---|---|
| Molecular Weight | 425.25662 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 82.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 425.25662 |
| Monoisotopic Mass | 425.25662 |
| Heavy Atoms | 31 |
| Complexity | 546.0 |
Chemical Identifiers
| CAS Number | 53497-79-3 |
|---|---|
| SMILES | COC1=C2C=C(CCC(CC3CCCC(N3)CC(CCC4=CC2=C(C=C4)O)O)O)C=C1 |
| InChIKey | IMHNVGKPQLKSHM-UHFFFAOYSA-N |
Product Overview
Lythranidine, (+-)- (CAS 53497-79-3), with molecular formula C26H35NO4 and molecular weight 425.25662 g/mol. IUPAC: 23-methoxy-25-azatetracyclo[18.3.1.12,6.111,15]hexacosa-1(23),2,4,6(26),20(24),21-hexaene-3,9,17-triol.
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