| Properties | Image |
|---|
| MNX_ID | MNXM962301 |
 |
| reference | slm:000654686 |
| formula | C53H95NO9P |
| global charge | -1 |
| mol weight | 921.315 |
| InChIKey | IMFRMQYQGMMPNW-IVOZQACNSA-M |
| InChI | InChI=1S/C53H96NO9P/c1-4-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-30-32-34-36-38-40-42-45-52(56)60-48-50(63-53(57)43-6-3)49-62-64(58,59)61-47-46-54-51(55)44-41-39-37-35-33-31-29-20-18-16-14-12-10-8-5-2/h13,15,19,21,23-24,26-27,50H,4-12,14,16-18,20,22,25,28-49H2,1-3H3,(H,54,55)(H,58,59)/p-1/b15-13-,21-19-,24-23-,27-26-/t50-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCCNC(=O)CCCCCCCCCCCCCCCCC)OC(=O)CCC |
MNX internals
| InChI (mnx) | InChI=1/C53H96NO9P/c1-4-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-30-32-34-36-38-40-42-45-52(56)60-48-50(63-53(57)43-6-3)49-62-64(58,59)61-47-46-54-51(55)44-41-39-37-35-33-31-29-20-18-16-14-12-10-8-5-2/h13,15,19,21,23-24,26-27,50H,4-12,14,16-18,20,22,25,28-49H2,1-3H3,(H,54,55)(H,58,59)/b15-13-,21-19-,24-23-,27-26-/t50-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:9][CH2:11]/[CH:13]=[CH:15]\[CH2:17]/[CH:19]=[CH:21]\[CH2:22]/[CH:23]=[CH:24]\[CH2:25]/[CH:26]=[CH:27]\[CH2:28][CH2:30][CH2:32][CH2:34][CH2:36][CH2:38][CH2:40][CH2:42][CH2:45][C:52](=[O:56])[O:60][CH2:48][C@H:50]([CH2:49][O:62][P:64]([OH:58])(=[O:59])[O:61][CH2:47][CH2:46][N:54]=[C:51]([CH2:44][CH2:41][CH2:39][CH2:37][CH2:35][CH2:33][CH2:31][CH2:29][CH2:20][CH2:18][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:5][CH3:2])[OH:55])[O:63][C:53]([CH2:43][CH2:6][CH3:3])=[O:57] |
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