| Properties | Image |
|---|
| MNX_ID | MNXM342616 |
 |
| reference | slm:000443667 |
| formula | C49H81O22P4 |
| global charge | -7 |
| mol weight | 1146.061 |
| InChIKey | VLZILZXBMBPKMG-WUVYAGIZSA-G |
| InChI | InChI=1S/C49H88O22P4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-43(51)67-42(39-65-41(2)50)40-66-75(63,64)71-46-44(52)47(68-72(54,55)56)49(70-74(60,61)62)48(45(46)53)69-73(57,58)59/h4-5,7-8,10-11,13-14,16-17,42,44-49,52-53H,3,6,9,12,15,18-40H2,1-2H3,(H,63,64)(H2,54,55,56)(H2,57,58,59)(H2,60,61,62)/p-7/b5-4-,8-7-,11-10-,14-13-,17-16-/t42-,44+,45+,46-,47+,48-,49-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCCCCCCCC(=O)O[C@H](COC(C)=O)COP(=O)([O-])O[C@H]1[C@H](O)[C@@H](OP(=O)([O-])[O-])[C@H](OP(=O)([O-])[O-])[C@@H](OP(=O)([O-])[O-])[C@H]1O |
MNX internals
| InChI (mnx) | InChI=1/C49H88O22P4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-43(51)67-42(39-65-41(2)50)40-66-75(63,64)71-46-44(52)47(68-72(54,55)56)49(70-74(60,61)62)48(45(46)53)69-73(57,58)59/h4-5,7-8,10-11,13-14,16-17,42,44-49,52-53H,3,6,9,12,15,18-40H2,1-2H3,(H,63,64)(H2,54,55,56)(H2,57,58,59)(H2,60,61,62)/b5-4-,8-7-,11-10-,14-13-,17-16-/t42-,44+,45+,46-,47+,48-,49-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:3]/[CH:4]=[CH:5]\[CH2:6]/[CH:7]=[CH:8]\[CH2:9]/[CH:10]=[CH:11]\[CH2:12]/[CH:13]=[CH:14]\[CH2:15]/[CH:16]=[CH:17]\[CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][C:43](=[O:51])[O:67][C@H:42]([CH2:39][O:65][C:41]([CH3:2])=[O:50])[CH2:40][O:66][P:75]([OH:63])(=[O:64])[O:71][C@@H:46]1[C@H:44]([OH:52])[C@H:47]([O:68][P:72]([OH:54])([OH:55])=[O:56])[C@@H:49]([O:70][P:74]([OH:60])([OH:61])=[O:62])[C@H:48]([O:69][P:73]([OH:57])([OH:58])=[O:59])[C@H:45]1[OH:53] |
|