| Properties | Image |
|---|
| MNX_ID | MNXM12444 |
 |
| reference | metacycM:CPD-13457 |
| formula | C24H37O22S |
| global charge | -1 |
| mol weight | 709.605 |
| InChIKey | GJJWTYKIIKCNMQ-FIJVXFBFSA-M |
| InChI | InChI=1S/C24H38O22S/c25-1-5-9(27)18(44-22-12(30)17-10(28)7(41-22)3-37-17)13(31)23(40-5)43-15-8-4-38-19(15)14(32)24(42-8)45-20-11(29)21(33)39-6(2-26)16(20)46-47(34,35)36/h5-33H,1-4H2,(H,34,35,36)/p-1/t5-,6-,7-,8-,9+,10+,11-,12-,13-,14-,15+,16+,17+,18+,19-,20-,21-,22-,23+,24-/m1/s1 |
| SMILES | O=S(=O)([O-])O[C@@H]1[C@H](O[C@H]2O[C@@H]3CO[C@H]([C@H]2O)[C@H]3O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O[C@H]3O[C@@H]4CO[C@@H]([C@H]4O)[C@H]3O)[C@H]2O)[C@@H](O)[C@H](O)O[C@@H]1CO |
MNX internals
| InChI (mnx) | InChI=1/C24H38O22S/c25-1-5-9(27)18(44-22-12(30)17-10(28)7(41-22)3-37-17)13(31)23(40-5)43-15-8-4-38-19(15)14(32)24(42-8)45-20-11(29)21(33)39-6(2-26)16(20)46-47(34,35)36/h5-33H,1-4H2,(H,34,35,36)/t5-,6-,7-,8-,9+,10+,11-,12-,13-,14-,15+,16+,17+,18+,19-,20-,21-,22-,23+,24-/m1/s1 |
 |
| SMILES (mnx) | [CH2:1]([C@@H:5]1[C@H:9]([OH:27])[C@H:18]([O:44][C@@H:22]2[C@H:12]([OH:30])[C@@H:17]3[C@@H:10]([OH:28])[C@@H:7]([CH2:3][O:37]3)[O:41]2)[C@@H:13]([OH:31])[C@H:23]([O:43][C@H:15]2[C@H:8]3[CH2:4][O:38][C@@H:19]2[C@@H:14]([OH:32])[C@@H:24]([O:45][C@@H:20]2[C@@H:11]([OH:29])[C@H:21]([OH:33])[O:39][C@H:6]([CH2:2][OH:26])[C@@H:16]2[O:46][S:47]([OH:34])(=[O:35])=[O:36])[O:42]3)[O:40]1)[OH:25] |
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