| Properties | Image |
|---|
| MNX_ID | MNXM1047725 |
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| reference | slm:000740114 |
| formula | C47H81NO8P |
| global charge | -1 |
| mol weight | 819.138 |
| InChIKey | WLCLSCNZRKTBGA-PQDSWUBRSA-M |
| InChI | InChI=1S/C47H82NO8P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-26-28-30-32-34-36-38-40-47(51)54-43-45(49)44-56-57(52,53)55-42-41-48-46(50)39-37-35-33-31-29-27-25-18-16-14-12-10-8-6-4-2/h11,13,17-19,21-22,24-26,30,32,45,49H,3-10,12,14-16,20,23,27-29,31,33-44H2,1-2H3,(H,48,50)(H,52,53)/p-1/b13-11-,19-17-,22-21-,25-18-,26-24-,32-30-/t45-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)OC[C@@H](O)COP(=O)([O-])OCCNC(=O)CCCCCCC/C=C\CCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C47H82NO8P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-26-28-30-32-34-36-38-40-47(51)54-43-45(49)44-56-57(52,53)55-42-41-48-46(50)39-37-35-33-31-29-27-25-18-16-14-12-10-8-6-4-2/h11,13,17-19,21-22,24-26,30,32,45,49H,3-10,12,14-16,20,23,27-29,31,33-44H2,1-2H3,(H,48,50)(H,52,53)/b13-11-,19-17-,22-21-,25-18-,26-24-,32-30-/t45-/m1/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:26]\[CH2:28]/[CH:30]=[CH:32]\[CH2:34][CH2:36][CH2:38][CH2:40][C:47](=[O:51])[O:54][CH2:43][C@H:45]([CH2:44][O:56][P:57]([OH:52])(=[O:53])[O:55][CH2:42][CH2:41][N:48]=[C:46]([CH2:39][CH2:37][CH2:35][CH2:33][CH2:31][CH2:29][CH2:27]/[CH:25]=[CH:18]\[CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])[OH:50])[OH:49] |
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