| Properties | Image |
|---|
| MNX_ID | MNXM957433 |
 |
| reference | slm:000649818 |
| formula | C56H97NO9P |
| global charge | -1 |
| mol weight | 959.364 |
| InChIKey | CCBUVNMNCOWIEP-JJJZKULJSA-M |
| InChI | InChI=1S/C56H98NO9P/c1-4-7-10-13-16-19-22-24-26-27-29-31-33-36-38-41-44-47-55(59)63-51-53(66-56(60)48-45-42-39-35-21-18-15-12-9-6-3)52-65-67(61,62)64-50-49-57-54(58)46-43-40-37-34-32-30-28-25-23-20-17-14-11-8-5-2/h16-17,19-20,24-26,28-29,31-32,34,53H,4-15,18,21-23,27,30,33,35-52H2,1-3H3,(H,57,58)(H,61,62)/p-1/b19-16-,20-17-,26-24-,28-25-,31-29-,34-32-/t53-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\CCCCCCC(=O)OC[C@H](COP(=O)([O-])OCCNC(=O)CCCC/C=C\C/C=C\C/C=C\CCCCC)OC(=O)CCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C56H98NO9P/c1-4-7-10-13-16-19-22-24-26-27-29-31-33-36-38-41-44-47-55(59)63-51-53(66-56(60)48-45-42-39-35-21-18-15-12-9-6-3)52-65-67(61,62)64-50-49-57-54(58)46-43-40-37-34-32-30-28-25-23-20-17-14-11-8-5-2/h16-17,19-20,24-26,28-29,31-32,34,53H,4-15,18,21-23,27,30,33,35-52H2,1-3H3,(H,57,58)(H,61,62)/b19-16-,20-17-,26-24-,28-25-,31-29-,34-32-/t53-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:24]=[CH:26]\[CH2:27]/[CH:29]=[CH:31]\[CH2:33][CH2:36][CH2:38][CH2:41][CH2:44][CH2:47][C:55](=[O:59])[O:63][CH2:51][C@H:53]([CH2:52][O:65][P:67]([OH:61])(=[O:62])[O:64][CH2:50][CH2:49][N:57]=[C:54]([CH2:46][CH2:43][CH2:40][CH2:37]/[CH:34]=[CH:32]\[CH2:30]/[CH:28]=[CH:25]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])[OH:58])[O:66][C:56]([CH2:48][CH2:45][CH2:42][CH2:39][CH2:35][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:60] |
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