HN8
Summary
| Name: | Haemanthamine |
| Synonyms: | Haemanthamin Natalensin; 3-Epicrinamine |
| Formula: | C17 H19 N O4 |
| Formal charge: | 0 |
| Formula weight: | 301.337 Da |
| Component type: | NON-POLYMER |
| Ambiguous Chemistry Warning: | The chemical description of this component is not well described in this definition. Descriptors and chemical names should be used with caution. |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C17H19NO4/c1-20-11-2-3-17-12-6-14-13(21-9-22-14)4-10(12)7-18(8-16(17)19)15(17)5-11/h2-4,6,11,15-16,19H,5,7-9H2,1H3/t11-,15+,16+,17+/m1/s1 |
| InChIKey | InChI | 1.03 | YGPRSGKVLATIHT-HSHDSVGOSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CO[C@H]1C[C@@H]2[N@@]3C[C@H](O)[C@@]2(C=C1)c4cc5OCOc5cc4C3 |
| SMILES | CACTVS | 3.385 | CO[CH]1C[CH]2[N]3C[CH](O)[C]2(C=C1)c4cc5OCOc5cc4C3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CO[C@H]1C[C@H]2[C@]3(C=C1)c4cc5c(cc4CN2C[C@@H]3O)OCO5 |
| SMILES | OpenEye OEToolkits | 2.0.6 | COC1CC2C3(C=C1)c4cc5c(cc4CN2CC3O)OCO5 |
