| PDB CCD ID: | M07 |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C15 H19 N O7 |
| InChI: | InChI=1S/C15H19NO7/c1-21-9-4-2-8(3-5-9)10-6-15(23-16-10)14(20)13(19)12(18)11(7-17)22-15/h2-5,11-14,17-20H,6-7H2,1H3/t11-,12-,13+,14-,15-/m1/s1 |
| InChIKey: | SCPKUJWXPVROSY-UXXRCYHCSA-N |
| SMILES: | | Software | SMILES |
|---|
| OpenEye OEToolkits 1.5.0 | COc1ccc(cc1)C2=NO[C@]3(C2)[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O | | CACTVS 3.341 | COc1ccc(cc1)C2=NO[C]3(C2)O[CH](CO)[CH](O)[CH](O)[CH]3O | | CACTVS 3.341 | COc1ccc(cc1)C2=NO[C@@]3(C2)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O | | ACDLabs 10.04 | N=2OC1(OC(C(O)C(O)C1O)CO)CC=2c3ccc(OC)cc3 | | OpenEye OEToolkits 1.5.0 | COc1ccc(cc1)C2=NOC3(C2)C(C(C(C(O3)CO)O)O)O |
|
| Name: | (5R,7R,8S,9S,10R)-7-(HYDROXYMETHYL)-3-(4-METHOXYPHENYL)-1,6-DIOXA-2-AZASPIRO[4.5]DEC-2-ENE-8,9,10-TRIOL;
(1R)-3'-(4-METHOXYPHENYL)-SPIRO[1,5-ANHYDRO-D-GLUCITOL-1,5'-ISOXAZOLINE] |
| ChEMBL: | CHEMBL593092 |
| ZINC: | ZINC000038965471 |
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