| Properties | Image |
|---|
| MNX_ID | MNXM216379 |
 |
| reference | slm:000021923 |
| formula | C49H79O8P |
| global charge | -2 |
| mol weight | 827.137 |
| InChIKey | DYRXMYHNFAHFBW-DPUMTWLKSA-L |
| InChI | InChI=1S/C49H81O8P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-30-31-33-35-37-39-41-43-48(50)55-45-47(46-56-58(52,53)54)57-49(51)44-42-40-38-36-34-32-29-18-16-14-12-10-8-6-4-2/h5,7,11-14,17-19,21-22,24-25,29,34,36,47H,3-4,6,8-10,15-16,20,23,26-28,30-33,35,37-46H2,1-2H3,(H2,52,53,54)/p-2/b7-5-,13-11-,14-12-,19-17-,22-21-,25-24-,29-18-,36-34-/t47-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])[O-])OC(=O)CCCC/C=C\C/C=C\C/C=C\CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C49H81O8P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-30-31-33-35-37-39-41-43-48(50)55-45-47(46-56-58(52,53)54)57-49(51)44-42-40-38-36-34-32-29-18-16-14-12-10-8-6-4-2/h5,7,11-14,17-19,21-22,24-25,29,34,36,47H,3-4,6,8-10,15-16,20,23,26-28,30-33,35,37-46H2,1-2H3,(H2,52,53,54)/b7-5-,13-11-,14-12-,19-17-,22-21-,25-24-,29-18-,36-34-/t47-/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][CH2:27][CH2:28][CH2:30][CH2:31][CH2:33][CH2:35][CH2:37][CH2:39][CH2:41][CH2:43][C:48](=[O:50])[O:55][CH2:45][C@H:47]([CH2:46][O:56][P:58]([OH:52])([OH:53])=[O:54])[O:57][C:49]([CH2:44][CH2:42][CH2:40][CH2:38]/[CH:36]=[CH:34]\[CH2:32]/[CH:29]=[CH:18]\[CH2:16]/[CH:14]=[CH:12]\[CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:51] |
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