| Properties | Image |
|---|
| MNX_ID | MNXM1037573 |
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| reference | slm:000729962 |
| formula | C57H107NO8P |
| global charge | -1 |
| mol weight | 965.456 |
| InChIKey | YCIATKMWKGIODI-YLJLZMBOSA-M |
| InChI | InChI=1S/C57H108NO8P/c1-4-7-10-12-14-16-18-20-22-23-24-25-26-27-28-29-30-31-32-34-36-38-40-42-44-47-51-63-53-55(66-57(60)49-45-9-6-3)54-65-67(61,62)64-52-50-58-56(59)48-46-43-41-39-37-35-33-21-19-17-15-13-11-8-5-2/h15,17,21,33,37,39,55H,4-14,16,18-20,22-32,34-36,38,40-54H2,1-3H3,(H,58,59)(H,61,62)/p-1/b17-15-,33-21-,39-37-/t55-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\CCCCC(=O)NCCOP(=O)([O-])OC[C@@H](COCCCCCCCCCCCCCCCCCCCCCCCCCCCC)OC(=O)CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C57H108NO8P/c1-4-7-10-12-14-16-18-20-22-23-24-25-26-27-28-29-30-31-32-34-36-38-40-42-44-47-51-63-53-55(66-57(60)49-45-9-6-3)54-65-67(61,62)64-52-50-58-56(59)48-46-43-41-39-37-35-33-21-19-17-15-13-11-8-5-2/h15,17,21,33,37,39,55H,4-14,16,18-20,22-32,34-36,38,40-54H2,1-3H3,(H,58,59)(H,61,62)/b17-15-,33-21-,39-37-/t55-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:12][CH2:14][CH2:16][CH2:18][CH2:20][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:34][CH2:36][CH2:38][CH2:40][CH2:42][CH2:44][CH2:47][CH2:51][O:63][CH2:53][C@H:55]([CH2:54][O:65][P:67]([OH:61])(=[O:62])[O:64][CH2:52][CH2:50][N:58]=[C:56]([CH2:48][CH2:46][CH2:43][CH2:41]/[CH:39]=[CH:37]\[CH2:35]/[CH:33]=[CH:21]\[CH2:19]/[CH:17]=[CH:15]\[CH2:13][CH2:11][CH2:8][CH2:5][CH3:2])[OH:59])[O:66][C:57]([CH2:49][CH2:45][CH2:9][CH2:6][CH3:3])=[O:60] |
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