| Properties | Image |
|---|
| MNX_ID | MNXM193233 |
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| reference | slm:000036974 |
| formula | C50H86O10P |
| global charge | -1 |
| mol weight | 878.202 |
| InChIKey | CIIYIDJIHZXNCS-SXJTUHDISA-M |
| InChI | InChI=1S/C50H87O10P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-28-29-31-33-35-37-39-41-49(53)57-45-48(46-59-61(55,56)58-44-47(52)43-51)60-50(54)42-40-38-36-34-32-30-27-18-16-14-12-10-8-6-4-2/h5,7,11,13-14,16-17,19,21-22,24-25,47-48,51-52H,3-4,6,8-10,12,15,18,20,23,26-46H2,1-2H3,(H,55,56)/p-1/b7-5-,13-11-,16-14+,19-17-,22-21-,25-24-/t47-,48+/m0/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OC[C@@H](O)CO)OC(=O)CCCCCCCCC/C=C/CCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C50H87O10P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-28-29-31-33-35-37-39-41-49(53)57-45-48(46-59-61(55,56)58-44-47(52)43-51)60-50(54)42-40-38-36-34-32-30-27-18-16-14-12-10-8-6-4-2/h5,7,11,13-14,16-17,19,21-22,24-25,47-48,51-52H,3-4,6,8-10,12,15,18,20,23,26-46H2,1-2H3,(H,55,56)/b7-5-,13-11-,16-14+,19-17-,22-21-,25-24-/t47-,48+/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][CH2:28][CH2:29][CH2:31][CH2:33][CH2:35][CH2:37][CH2:39][CH2:41][C:49](=[O:53])[O:57][CH2:45][C@H:48]([CH2:46][O:59][P:61]([OH:55])(=[O:56])[O:58][CH2:44][C@H:47]([CH2:43][OH:51])[OH:52])[O:60][C:50]([CH2:42][CH2:40][CH2:38][CH2:36][CH2:34][CH2:32][CH2:30][CH2:27][CH2:18]/[CH:16]=[CH:14]/[CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:54] |
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