basic_info |
|
| Product_Name: | 14-SALICYLOYLCARUBICIN |
| CAS: | 116907-26-7 |
| EnglishSynonyms: | 14-SALICYLOYLCARUBICIN |
| pro_mdlNumber: | MFCD01661512 |
| pro_acceptors: | 14 |
| pro_donors: | 7 |
| pro_smile: | C[C@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2C[C@@](Cc3c2c(c4c(c3O)C(=O)c5cccc(c5C4=O)O)O)(C(=O)COC(=O)c6ccccc6O)O)N)O |
| InChi: | InChI=1S/C33H31NO13/c1-13-27(38)17(34)9-22(46-13)47-20-11-33(44,21(37)12-45-32(43)14-5-2-3-7-18(14)35)10-16-24(20)31(42)26-25(29(16)40)28(39)15-6-4-8-19(36)23(15)30(26)41/h2-8,13,17,20,22,27,35-36,38,40,42,44H,9-12,34H2,1H3/t13-,17-,20-,22-,27+,33-/m0/s1 |
| InChiKey: | InChIKey=AJAHDRMPRTTZMX-AFFQMCQBSA-N |
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