| Properties | Image |
|---|
| MNX_ID | MNXM158164 |
 |
| reference | keggD:D10649 |
| formula | C18H33O49PS10 |
| global charge | 0 |
| mol weight | 1385.057 |
| InChIKey | RIYITPRTNFEGIA-QCOIXBDOSA-N |
| InChI | InChI=1S/C18H33O49PS10/c19-68(20,21)52-1-4-8(61-72(31,32)33)12(64-75(40,41)42)15(66-77(46,47)48)17(55-4)58-10-7(60-71(28,29)30)5(2-53-69(22,23)24)56-16(14(10)65-76(43,44)45)59-13-11(63-74(37,38)39)9(62-73(34,35)36)6(3-54-70(25,26)27)57-18(13)67-78(49,50)51/h4-18H,1-3H2,(H2,19,20,21)(H,22,23,24)(H,25,26,27)(H,28,29,30)(H,31,32,33)(H,34,35,36)(H,37,38,39)(H,40,41,42)(H,43,44,45)(H,46,47,48)(H,49,50,51)/t4-,5-,6-,7-,8-,9-,10+,11+,12+,13?,14+,15+,16-,17-,18?/m1/s1 |
| SMILES | O=P(O)(O)OC[C@H]1O[C@H](O[C@@H]2[C@H](OS(=O)(=O)O)[C@@H](OC3C(OS(=O)(=O)O)O[C@H](COS(=O)(=O)O)[C@@H](OS(=O)(=O)O)[C@@H]3OS(=O)(=O)O)O[C@H](COS(=O)(=O)O)[C@H]2OS(=O)(=O)O)[C@@H](OS(=O)(=O)O)[C@@H](OS(=O)(=O)O)[C@@H]1OS(=O)(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C18H33O49PS10/c19-68(20,21)52-1-4-8(61-72(31,32)33)12(64-75(40,41)42)15(66-77(46,47)48)17(55-4)58-10-7(60-71(28,29)30)5(2-53-69(22,23)24)56-16(14(10)65-76(43,44)45)59-13-11(63-74(37,38)39)9(62-73(34,35)36)6(3-54-70(25,26)27)57-18(13)67-78(49,50)51/h4-18H,1-3H2,(H2,19,20,21)(H,22,23,24)(H,25,26,27)(H,28,29,30)(H,31,32,33)(H,34,35,36)(H,37,38,39)(H,40,41,42)(H,43,44,45)(H,46,47,48)(H,49,50,51)/t4-,5-,6-,7-,8-,9-,10+,11+,12+,13?,14+,15+,16-,17-,18?/m1/s1 |
 |
| SMILES (mnx) | [CH2:1]([C@@H:4]1[C@@H:8]([O:61][S:72]([OH:31])(=[O:32])=[O:33])[C@H:12]([O:64][S:75]([OH:40])(=[O:41])=[O:42])[C@H:15]([O:66][S:77]([OH:46])(=[O:47])=[O:48])[C@@H:17]([O:58][C@H:10]2[C@H:7]([O:60][S:71]([OH:28])(=[O:29])=[O:30])[C@@H:5]([CH2:2][O:53][S:69]([OH:22])(=[O:23])=[O:24])[O:56][C@H:16]([O:59][CH:13]3[C@@H:11]([O:63][S:74]([OH:37])(=[O:38])=[O:39])[C@H:9]([O:62][S:73]([OH:34])(=[O:35])=[O:36])[C@@H:6]([CH2:3][O:54][S:70]([OH:25])(=[O:26])=[O:27])[O:57][CH:18]3[O:67][S:78]([OH:49])(=[O:50])=[O:51])[C@H:14]2[O:65][S:76]([OH:43])(=[O:44])=[O:45])[O:55]1)[O:52][P:68]([OH:19])([OH:20])=[O:21] |
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