ERI
Summary
| Name: | 3-C-methyl-4-O-acetyl-alpha-L-Olivopyranose |
| Synonyms: | 4-O-ACETYL-2,6-DIDEOXY-3-C-METHYL-BETA-L-ARABINO-HEXOPYRANOSE 3-C-methyl-4-O-acetyl-alpha-L-Olivose; 3-C-methyl-4-O-acetyl-L-Olivose; 3-C-methyl-4-O-acetyl-Olivose |
| Formula: | C9 H16 O5 |
| Formal charge: | 0 |
| Formula weight: | 204.22 Da |
| Component type: | L-saccharide, alpha linking |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 4-O-acetyl-2,6-dideoxy-3-C-methyl-alpha-L-arabino-hexopyranose |
| OpenEye OEToolkits | 1.7.6 | [(2S,3S,4S,6R)-2,4-dimethyl-4,6-bis(oxidanyl)oxan-3-yl] ethanoate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(OC1C(OC(O)CC1(O)C)C)C |
| InChI | InChI | 1.03 | InChI=1S/C9H16O5/c1-5-8(14-6(2)10)9(3,12)4-7(11)13-5/h5,7-8,11-12H,4H2,1-3H3/t5-,7+,8-,9-/m0/s1 |
| InChIKey | InChI | 1.03 | YJOQPCPEUGDGFS-VHKYIWFCSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C[C@@H]1O[C@@H](O)C[C@](C)(O)[C@H]1OC(C)=O |
| SMILES | CACTVS | 3.385 | C[CH]1O[CH](O)C[C](C)(O)[CH]1OC(C)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | C[C@H]1[C@@H]([C@@](C[C@@H](O1)O)(C)O)OC(=O)C |
| SMILES | OpenEye OEToolkits | 1.7.6 | CC1C(C(CC(O1)O)(C)O)OC(=O)C |
