7WK
Summary
| Name: | foliosidine |
| Synonyms: | 4-methoxy-1-methyl-8-[(2~{R})-3-methyl-2,3-bis(oxidanyl)butoxy]quinolin-2-one |
| Formula: | C16 H21 N O5 |
| Formal charge: | 0 |
| Formula weight: | 307.342 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 4-methoxy-1-methyl-8-[(2~{R})-3-methyl-2,3-bis(oxidanyl)butoxy]quinolin-2-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C16H21NO5/c1-16(2,20)13(18)9-22-11-7-5-6-10-12(21-4)8-14(19)17(3)15(10)11/h5-8,13,18,20H,9H2,1-4H3/t13-/m1/s1 |
| InChIKey | InChI | 1.03 | IUPYLWAXGAJZQC-CYBMUJFWSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COC1=CC(=O)N(C)c2c(OC[C@@H](O)C(C)(C)O)cccc12 |
| SMILES | CACTVS | 3.385 | COC1=CC(=O)N(C)c2c(OC[CH](O)C(C)(C)O)cccc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(C)([C@@H](COc1cccc2c1N(C(=O)C=C2OC)C)O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(C)(C(COc1cccc2c1N(C(=O)C=C2OC)C)O)O |
