| Properties | Image |
|---|
| MNX_ID | MNXM21878 |
 |
| reference | metacycM:CPD-12463 |
| formula | C30H52O26 |
| global charge | 0 |
| mol weight | 828.72 |
| InChIKey | ICZWAMMJCYLYCP-GPDDMXDKSA-N |
| InChI | InChI=1S/C30H52O26/c31-1-7-12(35)16(39)20(43)26(50-7)48-5-11-24(54-28-22(45)18(41)14(37)9(3-33)52-28)19(42)23(46)29(53-11)56-30(25(47)15(38)10(4-34)55-30)6-49-27-21(44)17(40)13(36)8(2-32)51-27/h7-29,31-47H,1-6H2/t7-,8-,9-,10-,11-,12+,13+,14+,15-,16+,17+,18+,19-,20-,21-,22-,23-,24-,25+,26+,27+,28-,29-,30+/m1/s1 |
| SMILES | OC[C@H]1O[C@H](OC[C@H]2O[C@H](O[C@]3(CO[C@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)O[C@H](CO)[C@@H](O)[C@@H]3O)[C@H](O)[C@@H](O)[C@@H]2O[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@H]1O |
MNX internals
| InChI (mnx) | InChI=1/C30H52O26/c31-1-7-12(35)16(39)20(43)26(50-7)48-5-11-24(54-28-22(45)18(41)14(37)9(3-33)52-28)19(42)23(46)29(53-11)56-30(25(47)15(38)10(4-34)55-30)6-49-27-21(44)17(40)13(36)8(2-32)51-27/h7-29,31-47H,1-6H2/t7-,8-,9-,10-,11-,12+,13+,14+,15-,16+,17+,18+,19-,20-,21-,22-,23-,24-,25+,26+,27+,28-,29-,30+/m1/s1 |
 |
| SMILES (mnx) | [CH2:1]([C@@H:7]1[C@H:12]([OH:35])[C@H:16]([OH:39])[C@@H:20]([OH:43])[C@@H:26]([O:48][CH2:5][C@@H:11]2[C@@H:24]([O:54][C@@H:28]3[C@H:22]([OH:45])[C@@H:18]([OH:41])[C@@H:14]([OH:37])[C@@H:9]([CH2:3][OH:33])[O:52]3)[C@H:19]([OH:42])[C@@H:23]([OH:46])[C@@H:29]([O:56][C@@:30]3([CH2:6][O:49][C@@H:27]4[C@H:21]([OH:44])[C@@H:17]([OH:40])[C@@H:13]([OH:36])[C@@H:8]([CH2:2][OH:32])[O:51]4)[C@@H:25]([OH:47])[C@H:15]([OH:38])[C@@H:10]([CH2:4][OH:34])[O:55]3)[O:53]2)[O:50]1)[OH:31] |
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