| Properties | Image |
|---|
| MNX_ID | MNXM41329 |
 |
| reference | chebi:59291 |
| formula | C16H26O15 |
| global charge | 0 |
| mol weight | 458.369 |
| InChIKey | FSEWYZAGVUQKLQ-NNZUOWEZSA-N |
| InChI | InChI=1S/C16H26O15/c17-3-7(20)11-10(23)6(19)2-16(31-11,14(26)27)29-4-8(21)12-9(22)5(18)1-15(28,30-12)13(24)25/h5-12,17-23,28H,1-4H2,(H,24,25)(H,26,27)/t5-,6-,7-,8-,9-,10-,11-,12-,15-,16-/m1/s1 |
| SMILES | O=C(O)[C@@]1(OC[C@@H](O)[C@H]2O[C@@](O)(C(=O)O)C[C@@H](O)[C@H]2O)C[C@@H](O)[C@@H](O)[C@@H]([C@H](O)CO)O1 |
MNX internals
| InChI (mnx) | InChI=1/C16H26O15/c17-3-7(20)11-10(23)6(19)2-16(31-11,14(26)27)29-4-8(21)12-9(22)5(18)1-15(28,30-12)13(24)25/h5-12,17-23,28H,1-4H2,(H,24,25)(H,26,27)/t5-,6-,7-,8-,9-,10-,11-,12-,15-,16-/m1/s1 |
 |
| SMILES (mnx) | [CH2:1]1[C@@H:5]([OH:18])[C@@H:9]([OH:22])[C@@H:12]([C@@H:8]([CH2:4][O:29][C@:16]2([C:14](=[O:26])[OH:27])[CH2:2][C@@H:6]([OH:19])[C@@H:10]([OH:23])[C@@H:11]([C@@H:7]([CH2:3][OH:17])[OH:20])[O:31]2)[OH:21])[O:30][C@:15]1([C:13](=[O:24])[OH:25])[OH:28] |
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