| Name： | CANDIDINE METHYL ESTER HYDROCHLORIDE |
| CAS： | 39387-88-7 |
| Synonyms： | CANDIDINE METHYL ESTER HYDROCHLORIDE |
| MDL.： | MFCD01745317 |
| H bond acceptor： | 18 |
| H bond donor： | 10 |
| Smile： | C[C@H]1/C=C/C=C/C=C/C=C/C=C/C=C/C=C/[C@@H](C[C@H]2[C@@H]([C@H](C[C@](O2)(C[C@H](C(CCC(=O)C[C@H](C[C@H](CC(=O)O[C@H]([C@@H]([C@@H]1O)C)C)O)O)O)O)O)O)C(=O)OC)O[C@H]3[C@H]([C@H]([C@@H]([C@H](O3)C)O)N)O |
| InChi： | InChI=1S/C48H73NO17/c1-28-18-16-14-12-10-8-6-7-9-11-13-15-17-19-35(65-47-45(59)42(49)44(58)31(4)64-47)25-39-41(46(60)62-5)38(55)27-48(61,66-39)26-37(54)36(53)21-20-32(50)22-33(51)23-34(52)24-40(56)63-30(3)29(2)43(28)57/h6-19,28-31,33-39,41-45,47,51-55,57-59,61H,20-27,49H2,1-5H3/b7-6+,10-8+,11-9+,14-12+,15-13+,18-16+,19-17+/t28-,29-,30-,31+,33+,34+,35-,36?,37+,38-,39-,41+,42-,43+,44+,45-,47-,48+/m0/s1 |
| InChiKey： | InChIKey=BUNUWEVTHKFJCP-LVRSHKEISA-N |
CANDIDINE METHYL ESTER HYDROCHLORIDE
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