| Properties | Image |
|---|
| MNX_ID | MNXM233194 |
 |
| reference | slm:000447014 |
| formula | C51H88O19P3 |
| global charge | -5 |
| mol weight | 1098.168 |
| InChIKey | JFONQRDOENRWSH-PURBDTNISA-I |
| InChI | InChI=1S/C51H93O19P3/c1-3-5-7-9-11-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-32-33-35-37-39-44(52)65-41-43(67-45(53)40-38-36-34-31-12-10-8-6-4-2)42-66-73(63,64)70-51-47(55)49(68-71(57,58)59)46(54)50(48(51)56)69-72(60,61)62/h11,13,15-16,18-19,21-22,43,46-51,54-56H,3-10,12,14,17,20,23-42H2,1-2H3,(H,63,64)(H2,57,58,59)(H2,60,61,62)/p-5/b13-11-,16-15-,19-18-,22-21-/t43-,46-,47-,48-,49-,50+,51-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])O[C@@H]1[C@H](O)[C@H](OP(=O)([O-])[O-])[C@@H](O)[C@H](OP(=O)([O-])[O-])[C@H]1O)OC(=O)CCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C51H93O19P3/c1-3-5-7-9-11-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-32-33-35-37-39-44(52)65-41-43(67-45(53)40-38-36-34-31-12-10-8-6-4-2)42-66-73(63,64)70-51-47(55)49(68-71(57,58)59)46(54)50(48(51)56)69-72(60,61)62/h11,13,15-16,18-19,21-22,43,46-51,54-56H,3-10,12,14,17,20,23-42H2,1-2H3,(H,63,64)(H2,57,58,59)(H2,60,61,62)/b13-11-,16-15-,19-18-,22-21-/t43-,46-,47-,48-,49-,50+,51-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9]/[CH:11]=[CH:13]\[CH2:14]/[CH:15]=[CH:16]\[CH2:17]/[CH:18]=[CH:19]\[CH2:20]/[CH:21]=[CH:22]\[CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:32][CH2:33][CH2:35][CH2:37][CH2:39][C:44](=[O:52])[O:65][CH2:41][C@H:43]([CH2:42][O:66][P:73]([OH:63])(=[O:64])[O:70][C@@H:51]1[C@H:47]([OH:55])[C@H:49]([O:68][P:71]([OH:57])([OH:58])=[O:59])[C@@H:46]([OH:54])[C@H:50]([O:69][P:72]([OH:60])([OH:61])=[O:62])[C@H:48]1[OH:56])[O:67][C:45]([CH2:40][CH2:38][CH2:36][CH2:34][CH2:31][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:53] |
|