| Properties | Image |
|---|
| MNX_ID | MNXM233105 |
 |
| reference | slm:000038291 |
| formula | C54H96O10P |
| global charge | -1 |
| mol weight | 936.326 |
| InChIKey | QUWRFFJQVFQPEW-WUANOSAZSA-M |
| InChI | InChI=1S/C54H97O10P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-29-30-32-33-35-37-39-41-43-45-53(57)61-49-52(50-63-65(59,60)62-48-51(56)47-55)64-54(58)46-44-42-40-38-36-34-31-18-16-14-12-10-8-6-4-2/h11,13,17-19,21-22,24-25,31,51-52,55-56H,3-10,12,14-16,20,23,26-30,32-50H2,1-2H3,(H,59,60)/p-1/b13-11-,19-17-,22-21-,25-24-,31-18-/t51-,52+/m0/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OC[C@@H](O)CO)OC(=O)CCCCCCC/C=C\CCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C54H97O10P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-29-30-32-33-35-37-39-41-43-45-53(57)61-49-52(50-63-65(59,60)62-48-51(56)47-55)64-54(58)46-44-42-40-38-36-34-31-18-16-14-12-10-8-6-4-2/h11,13,17-19,21-22,24-25,31,51-52,55-56H,3-10,12,14-16,20,23,26-30,32-50H2,1-2H3,(H,59,60)/b13-11-,19-17-,22-21-,25-24-,31-18-/t51-,52+/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]\[CH2:20]/[CH:21]=[CH:22]\[CH2:23]/[CH:24]=[CH:25]\[CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:32][CH2:33][CH2:35][CH2:37][CH2:39][CH2:41][CH2:43][CH2:45][C:53](=[O:57])[O:61][CH2:49][C@H:52]([CH2:50][O:63][P:65]([OH:59])(=[O:60])[O:62][CH2:48][C@H:51]([CH2:47][OH:55])[OH:56])[O:64][C:54]([CH2:46][CH2:44][CH2:42][CH2:40][CH2:38][CH2:36][CH2:34]/[CH:31]=[CH:18]\[CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:58] |
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