| Properties | Image |
|---|
| MNX_ID | MNXM106296 |
 |
| reference | chebi:69648 |
| formula | C24H32ClNO10 |
| global charge | 0 |
| mol weight | 529.97 |
| InChIKey | NXVSHRKSOYHAHU-GVTJHXRVSA-M |
| InChI | InChI=1S/C24H32NO10.ClH/c1-3-15-16(7-6-14-5-4-8-25(11-14)9-10-26)17(22(31)32-2)13-33-23(15)35-24-21(30)20(29)19(28)18(12-27)34-24;/h3-8,11,13,15-16,18-21,23-24,26-30H,1,9-10,12H2,2H3;1H/q+1;/p-1/b7-6+;/t15-,16+,18-,19-,20+,21-,23+,24+;/m1./s1 |
| SMILES | C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1/C=C/C1=CC=C[N+](CCO)=C1.[Cl-] |
MNX internals
| InChI (mnx) | InChI=1/C24H32NO10.ClH/c1-3-15-16(7-6-14-5-4-8-25(11-14)9-10-26)17(22(31)32-2)13-33-23(15)35-24-21(30)20(29)19(28)18(12-27)34-24;/h3-8,11,13,15-16,18-21,23-24,26-30H,1,9-10,12H2,2H3;1H/q+1;/b7-6+;/t15-,16+,18-,19-,20+,21-,23+,24+;/m1./s1 |
 |
| SMILES (mnx) | [CH2:1]=[CH:3][C@@H:15]1[C@H:16](/[CH:7]=[CH:6]/[C:14]2=[CH:11][N+:25]([CH2:9][CH2:10][OH:26])=[CH:8][CH:4]=[CH:5]2)[C:17]([C:22](=[O:31])[O:32][CH3:2])=[CH:13][O:33][C@H:23]1[O:35][C@H:24]1[C@H:21]([OH:30])[C@@H:20]([OH:29])[C@H:19]([OH:28])[C@@H:18]([CH2:12][OH:27])[O:34]1.[ClH:36] |
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