| Properties | Image |
|---|
| MNX_ID | MNXM319409 |
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| reference | slm:000475099 |
| formula | C56H93O13P2 |
| global charge | -3 |
| mol weight | 1036.295 |
| InChIKey | UEPATLQTCLTJJD-JDYRTFRESA-K |
| InChI | InChI=1S/C56H96O13P2/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-29-30-31-32-34-36-38-40-42-44-46-48-56(59)69-54(52-68-71(63,64)67-50-53(57)49-66-70(60,61)62)51-65-55(58)47-45-43-41-39-37-35-33-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-19,21-22,24-25,33,53-54,57H,3-4,9-10,15-16,20,23,26-32,34-52H2,1-2H3,(H,63,64)(H2,60,61,62)/p-3/b7-5-,8-6-,13-11-,14-12-,19-17-,22-21-,25-24-,33-18-/t53-,54+/m0/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC)COP(=O)([O-])OC[C@@H](O)COP(=O)([O-])[O-] |
MNX internals
| InChI (mnx) | InChI=1/C56H96O13P2/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-29-30-31-32-34-36-38-40-42-44-46-48-56(59)69-54(52-68-71(63,64)67-50-53(57)49-66-70(60,61)62)51-65-55(58)47-45-43-41-39-37-35-33-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-19,21-22,24-25,33,53-54,57H,3-4,9-10,15-16,20,23,26-32,34-52H2,1-2H3,(H,63,64)(H2,60,61,62)/b7-5-,8-6-,13-11-,14-12-,19-17-,22-21-,25-24-,33-18-/t53-,54+/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3]/[CH:5]=[CH:7]\[CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:19]\[CH2:20]/[CH:21]=[CH:22]\[CH2:23]/[CH:24]=[CH:25]\[CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:34][CH2:36][CH2:38][CH2:40][CH2:42][CH2:44][CH2:46][CH2:48][C:56](=[O:59])[O:69][C@H:54]([CH2:51][O:65][C:55]([CH2:47][CH2:45][CH2:43][CH2:41][CH2:39][CH2:37][CH2:35]/[CH:33]=[CH:18]\[CH2:16]/[CH:14]=[CH:12]\[CH2:10]/[CH:8]=[CH:6]\[CH2:4][CH3:2])=[O:58])[CH2:52][O:68][P:71]([OH:63])(=[O:64])[O:67][CH2:50][C@H:53]([CH2:49][O:66][P:70]([OH:60])([OH:61])=[O:62])[OH:57] |
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