| Properties | Image |
|---|
| MNX_ID | MNXM210624 |
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| reference | slm:000021711 |
| formula | C50H85O8P |
| global charge | -2 |
| mol weight | 845.196 |
| InChIKey | XNBIWHLTGMDKQU-SBCNVHNKSA-L |
| InChI | InChI=1S/C50H87O8P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-29-30-31-33-34-36-38-40-42-44-49(51)56-46-48(47-57-59(53,54)55)58-50(52)45-43-41-39-37-35-32-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,21-22,24-25,27-28,48H,3-4,6,8-10,12,14-16,18,20,23,26,29-47H2,1-2H3,(H2,53,54,55)/p-2/b7-5-,13-11-,19-17-,22-21-,25-24-,28-27-/t48-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])[O-])OC(=O)CCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C50H87O8P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-29-30-31-33-34-36-38-40-42-44-49(51)56-46-48(47-57-59(53,54)55)58-50(52)45-43-41-39-37-35-32-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,21-22,24-25,27-28,48H,3-4,6,8-10,12,14-16,18,20,23,26,29-47H2,1-2H3,(H2,53,54,55)/b7-5-,13-11-,19-17-,22-21-,25-24-,28-27-/t48-/m1/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]/[CH:27]=[CH:28]\[CH2:29][CH2:30][CH2:31][CH2:33][CH2:34][CH2:36][CH2:38][CH2:40][CH2:42][CH2:44][C:49](=[O:51])[O:56][CH2:46][C@H:48]([CH2:47][O:57][P:59]([OH:53])([OH:54])=[O:55])[O:58][C:50]([CH2:45][CH2:43][CH2:41][CH2:39][CH2:37][CH2:35][CH2:32][CH2:18][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:52] |
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