basic_info |
|
| Product_Name: | B-D-MANNOPYRANOSIDE, ETHYL 3-O-(PHENYLMETHYL)-1-THIO-, 4,6-DIBENZOATE |
| CAS: | 562075-80-3 |
| EnglishSynonyms: | B-D-MANNOPYRANOSIDE, ETHYL 3-O-(PHENYLMETHYL)-1-THIO-, 4,6-DIBENZOATE |
| pro_mdlNumber: | MFCD13182943 |
| pro_acceptors: | 7 |
| pro_donors: | 1 |
| pro_smile: | CCS[C@@H]1O[C@H](COC(=O)C2=CC=CC=C2)[C@@H](OC(=O)C2=CC=CC=C2)[C@H](OCC2=CC=CC=C2)[C@@H]1O |
| InChi: | InChI=1S/C29H30O7S/c1-2-37-29-24(30)26(33-18-20-12-6-3-7-13-20)25(36-28(32)22-16-10-5-11-17-22)23(35-29)19-34-27(31)21-14-8-4-9-15-21/h3-17,23-26,29-30H,2,18-19H2,1H3/t23-,24+,25-,26-,29+/m1/s1 |
| InChiKey: | InChIKey=QIWSIYOSIGGOHX-HFYATBSASA-N |
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