VI4
Summary
| Name: | 13-(3-Amino-2,3,6-trideoxy-alpha-L-ribo-hexopyranosyl)-6,7,12,13-tetrahydro-5H-indolo[2,3-a]pyrrolo[3,4-c]carbazol-5-one |
| Formula: | C26 H24 N4 O3 |
| Formal charge: | 0 |
| Formula weight: | 440.494 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 | 1.06 | InChI=1S/C26H24N4O3/c1-12-25(31)16(27)10-19(33-12)30-18-9-5-3-7-14(18)21-22-15(11-28-26(22)32)20-13-6-2-4-8-17(13)29-23(20)24(21)30/h2-9,12,16,19,25,29,31H,10-11,27H2,1H3,(H,28,32)/t12-,16+,19+,25-/m0/s1 |
| InChIKey | InChI | 1.06 | QNQXRLNOOGRQEB-FUJFFIKUSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C[C@@H]1O[C@H](C[C@@H](N)[C@H]1O)n2c3ccccc3c4c2c5[nH]c6ccccc6c5c7CNC(=O)c47 |
| SMILES | CACTVS | 3.385 | C[CH]1O[CH](C[CH](N)[CH]1O)n2c3ccccc3c4c2c5[nH]c6ccccc6c5c7CNC(=O)c47 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C[C@H]1[C@@H]([C@@H](C[C@@H](O1)n2c3ccccc3c4c2c5c(c6ccccc6[nH]5)c7c4C(=O)NC7)N)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC1C(C(CC(O1)n2c3ccccc3c4c2c5c(c6ccccc6[nH]5)c7c4C(=O)NC7)N)O |
