| PDB CCD ID: | LBL |
| Number of entries in BioLiP: | 4 |
| Chemical formula: | C12 H22 O11 |
| InChI: | InChI=1S/C12H22O11/c13-1-4(16)7(18)11(5(17)2-14)23-12-10(21)9(20)8(19)6(3-15)22-12/h1,4-12,14-21H,2-3H2/t4-,5+,6+,7+,8-,9-,10+,11+,12-/m0/s1 |
| InChIKey: | DKXNBNKWCZZMJT-JVCRWLNRSA-N |
| SMILES: | | Software | SMILES |
|---|
| CACTVS 3.385 | OC[CH](O)[CH](O[CH]1O[CH](CO)[CH](O)[CH](O)[CH]1O)[CH](O)[CH](O)C=O | | OpenEye OEToolkits 2.0.7 | C(C1C(C(C(C(O1)OC(C(CO)O)C(C(C=O)O)O)O)O)O)O | | OpenEye OEToolkits 2.0.7 | C([C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O[C@H]([C@@H](CO)O)[C@@H]([C@H](C=O)O)O)O)O)O)O | | CACTVS 3.385 | OC[C@@H](O)[C@@H](O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)[C@H](O)[C@@H](O)C=O |
|
| Name: | (2~{R},3~{R},4~{R},5~{R})-4-[(2~{S},3~{R},4~{S},5~{R},6~{R})-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-2,3,5, 6-tetrakis(oxidanyl)hexanal;
4-O-beta-D-Galactopyranosyl-D-glucose |
| ZINC: | ZINC000100045818 |
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