| Properties | Image |
|---|
| MNX_ID | MNXM1104657 |
 |
| reference | biggM:core2 |
| formula | C22H37N2O15* |
| global charge | 0 |
| mol weight | |
| InChIKey | |
| InChI | |
| SMILES | [*]C1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2NC(C)=O)[C@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H]1NC(C)=O |
MNX internals
| InChI (mnx) | InChI=1/C23H40N2O15/c1-7-13(24-8(2)28)21(40-23-20(35)19(34)16(31)11(5-27)39-23)17(32)12(37-7)6-36-22-14(25-9(3)29)18(33)15(30)10(4-26)38-22/h7,10-23,26-27,30-35H,4-6H2,1-3H3,(H,24,28)(H,25,29)/t7?,10-,11-,12-,13+,14-,15-,16+,17+,18-,19+,20-,21-,22-,23+/m1/s1/i1+1 |
 |
| SMILES (mnx) | [13CH3:1][CH:7]1[C@H:13]([N:24]=[C:8]([CH3:2])[OH:28])[C@@H:21]([O:40][C@H:23]2[C@H:20]([OH:35])[C@@H:19]([OH:34])[C@@H:16]([OH:31])[C@@H:11]([CH2:5][OH:27])[O:39]2)[C@@H:17]([OH:32])[C@@H:12]([CH2:6][O:36][C@H:22]2[C@H:14]([N:25]=[C:9]([CH3:3])[OH:29])[C@@H:18]([OH:33])[C@H:15]([OH:30])[C@@H:10]([CH2:4][OH:26])[O:38]2)[O:37]1 |
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