| Properties | Image |
|---|
| MNX_ID | MNXM958854 |
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| reference | slm:000651239 |
| formula | C53H95NO9P |
| global charge | -1 |
| mol weight | 921.315 |
| InChIKey | OSIKZHYUSQUKRX-RPKAEUNNSA-M |
| InChI | InChI=1S/C53H96NO9P/c1-4-7-10-13-16-19-21-23-24-25-26-28-29-32-35-38-41-44-52(56)60-48-50(63-53(57)45-42-39-36-33-30-27-22-20-17-14-11-8-5-2)49-62-64(58,59)61-47-46-54-51(55)43-40-37-34-31-18-15-12-9-6-3/h16,19,23-24,26,28,32,35,50H,4-15,17-18,20-22,25,27,29-31,33-34,36-49H2,1-3H3,(H,54,55)(H,58,59)/p-1/b19-16-,24-23-,28-26-,35-32-/t50-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)OC[C@H](COP(=O)([O-])OCCNC(=O)CCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C53H96NO9P/c1-4-7-10-13-16-19-21-23-24-25-26-28-29-32-35-38-41-44-52(56)60-48-50(63-53(57)45-42-39-36-33-30-27-22-20-17-14-11-8-5-2)49-62-64(58,59)61-47-46-54-51(55)43-40-37-34-31-18-15-12-9-6-3/h16,19,23-24,26,28,32,35,50H,4-15,17-18,20-22,25,27,29-31,33-34,36-49H2,1-3H3,(H,54,55)(H,58,59)/b19-16-,24-23-,28-26-,35-32-/t50-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:21]/[CH:23]=[CH:24]\[CH2:25]/[CH:26]=[CH:28]\[CH2:29]/[CH:32]=[CH:35]\[CH2:38][CH2:41][CH2:44][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]([CH2:43][CH2:40][CH2:37][CH2:34][CH2:31][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[OH:55])[O:63][C:53]([CH2:45][CH2:42][CH2:39][CH2:36][CH2:33][CH2:30][CH2:27][CH2:22][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:57] |
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