| Properties | Image |
|---|
| MNX_ID | MNXM217885 |
 |
| reference | slm:000472137 |
| formula | C55H99O13P2 |
| global charge | -3 |
| mol weight | 1030.332 |
| InChIKey | FRXVSVFAUWXFOV-ZRNBHCQJSA-K |
| InChI | InChI=1S/C55H102O13P2/c1-3-5-7-9-11-13-15-17-19-21-23-24-25-26-27-28-29-31-32-34-36-38-40-42-44-46-54(57)64-50-53(51-67-70(62,63)66-49-52(56)48-65-69(59,60)61)68-55(58)47-45-43-41-39-37-35-33-30-22-20-18-16-14-12-10-8-6-4-2/h11,13,17,19,23-24,26-27,52-53,56H,3-10,12,14-16,18,20-22,25,28-51H2,1-2H3,(H,62,63)(H2,59,60,61)/p-3/b13-11-,19-17-,24-23-,27-26-/t52-,53+/m0/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OC[C@@H](O)COP(=O)([O-])[O-])OC(=O)CCCCCCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C55H102O13P2/c1-3-5-7-9-11-13-15-17-19-21-23-24-25-26-27-28-29-31-32-34-36-38-40-42-44-46-54(57)64-50-53(51-67-70(62,63)66-49-52(56)48-65-69(59,60)61)68-55(58)47-45-43-41-39-37-35-33-30-22-20-18-16-14-12-10-8-6-4-2/h11,13,17,19,23-24,26-27,52-53,56H,3-10,12,14-16,18,20-22,25,28-51H2,1-2H3,(H,62,63)(H2,59,60,61)/b13-11-,19-17-,24-23-,27-26-/t52-,53+/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:19]\[CH2:21]/[CH:23]=[CH:24]\[CH2:25]/[CH:26]=[CH:27]\[CH2:28][CH2:29][CH2:31][CH2:32][CH2:34][CH2:36][CH2:38][CH2:40][CH2:42][CH2:44][CH2:46][C:54](=[O:57])[O:64][CH2:50][C@H:53]([CH2:51][O:67][P:70]([OH:62])(=[O:63])[O:66][CH2:49][C@H:52]([CH2:48][O:65][P:69]([OH:59])([OH:60])=[O:61])[OH:56])[O:68][C:55]([CH2:47][CH2:45][CH2:43][CH2:41][CH2:39][CH2:37][CH2:35][CH2:33][CH2:30][CH2:22][CH2:20][CH2:18][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:58] |
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