| Properties | Image |
|---|
| MNX_ID | MNXM1009377 |
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| reference | slm:000701765 |
| formula | C50H93NO8P |
| global charge | -1 |
| mol weight | 867.267 |
| InChIKey | BBWXVEBSZNXLAD-BIOCAXJUSA-M |
| InChI | InChI=1S/C50H94NO8P/c1-5-7-9-11-13-14-15-16-17-18-22-25-29-32-36-40-49(52)51-42-44-57-60(54,55)58-46-48(59-50(53)41-37-33-27-12-10-8-6-2)45-56-43-38-34-30-26-23-20-19-21-24-28-31-35-39-47(3)4/h13-14,16-17,38,43,47-48H,5-12,15,18-37,39-42,44-46H2,1-4H3,(H,51,52)(H,54,55)/p-1/b14-13-,17-16-,43-38-/t48-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\CCCCCCCC(=O)NCCOP(=O)([O-])OC[C@@H](CO/C=C\CCCCCCCCCCCCC(C)C)OC(=O)CCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C50H94NO8P/c1-5-7-9-11-13-14-15-16-17-18-22-25-29-32-36-40-49(52)51-42-44-57-60(54,55)58-46-48(59-50(53)41-37-33-27-12-10-8-6-2)45-56-43-38-34-30-26-23-20-19-21-24-28-31-35-39-47(3)4/h13-14,16-17,38,43,47-48H,5-12,15,18-37,39-42,44-46H2,1-4H3,(H,51,52)(H,54,55)/b14-13-,17-16-,43-38-/t48-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:5][CH2:7][CH2:9][CH2:11]/[CH:13]=[CH:14]\[CH2:15]/[CH:16]=[CH:17]\[CH2:18][CH2:22][CH2:25][CH2:29][CH2:32][CH2:36][CH2:40][C:49](=[N:51][CH2:42][CH2:44][O:57][P:60]([OH:54])(=[O:55])[O:58][CH2:46][C@@H:48]([CH2:45][O:56]/[CH:43]=[CH:38]\[CH2:34][CH2:30][CH2:26][CH2:23][CH2:20][CH2:19][CH2:21][CH2:24][CH2:28][CH2:31][CH2:35][CH2:39][CH:47]([CH3:3])[CH3:4])[O:59][C:50]([CH2:41][CH2:37][CH2:33][CH2:27][CH2:12][CH2:10][CH2:8][CH2:6][CH3:2])=[O:53])[OH:52] |
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