| Properties | Image |
|---|
| MNX_ID | MNXM1128743 |
 |
| reference | chebi:167485 |
| formula | C26H45NO24S |
| global charge | 0 |
| mol weight | 787.696 |
| InChIKey | ZTFJOGYDMUDILT-WEVGNWFESA-N |
| InChI | InChI=1S/C26H45NO24S/c1-6(32)27-11-14(35)19(48-26-18(39)22(51-52(41,42)43)13(34)8(3-29)46-26)10(5-31)47-24(11)50-21-12(33)7(2-28)45-25(17(21)38)49-20-9(4-30)44-23(40)16(37)15(20)36/h7-26,28-31,33-40H,2-5H2,1H3,(H,27,32)(H,41,42,43)/t7-,8-,9-,10-,11-,12+,13+,14-,15-,16-,17-,18-,19-,20-,21+,22+,23?,24+,25+,26+/m1/s1 |
| SMILES | CC(=O)N[C@H]1[C@H](O[C@H]2[C@@H](O)[C@@H](CO)O[C@@H](O[C@H]3[C@H](O)[C@@H](O)C(O)O[C@@H]3CO)[C@@H]2O)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](OS(=O)(=O)O)[C@H]2O)[C@@H]1O |
MNX internals
| InChI (mnx) | InChI=1/C26H45NO24S/c1-6(32)27-11-14(35)19(48-26-18(39)22(51-52(41,42)43)13(34)8(3-29)46-26)10(5-31)47-24(11)50-21-12(33)7(2-28)45-25(17(21)38)49-20-9(4-30)44-23(40)16(37)15(20)36/h7-26,28-31,33-40H,2-5H2,1H3,(H,27,32)(H,41,42,43)/t7-,8-,9-,10-,11-,12+,13+,14-,15-,16-,17-,18-,19-,20-,21+,22+,23?,24+,25+,26+/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][C:6](=[N:27][C@@H:11]1[C@@H:14]([OH:35])[C@H:19]([O:48][C@H:26]2[C@H:18]([OH:39])[C@@H:22]([O:51][S:52]([OH:41])(=[O:42])=[O:43])[C@@H:13]([OH:34])[C@@H:8]([CH2:3][OH:29])[O:46]2)[C@@H:10]([CH2:5][OH:31])[O:47][C@H:24]1[O:50][C@H:21]1[C@@H:12]([OH:33])[C@@H:7]([CH2:2][OH:28])[O:45][C@@H:25]([O:49][C@@H:20]2[C@@H:9]([CH2:4][OH:30])[O:44][CH:23]([OH:40])[C@H:16]([OH:37])[C@H:15]2[OH:36])[C@@H:17]1[OH:38])[OH:32] |
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