| Properties | Image |
|---|
| MNX_ID | MNXM938776 |
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| reference | slm:000631161 |
| formula | C53H93NO9P |
| global charge | -1 |
| mol weight | 919.299 |
| InChIKey | MPKGKMRVNKWFFV-IHOPZAQPSA-M |
| InChI | InChI=1S/C53H94NO9P/c1-4-7-9-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-40-42-45-52(56)60-48-50(63-53(57)43-6-3)49-62-64(58,59)61-47-46-54-51(55)44-41-39-10-8-5-2/h7,9,12-13,15-16,18-19,21-22,50H,4-6,8,10-11,14,17,20,23-49H2,1-3H3,(H,54,55)(H,58,59)/p-1/b9-7-,13-12-,16-15-,19-18-,22-21-/t50-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCCNC(=O)CCCCCCC)OC(=O)CCC |
MNX internals
| InChI (mnx) | InChI=1/C53H94NO9P/c1-4-7-9-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-40-42-45-52(56)60-48-50(63-53(57)43-6-3)49-62-64(58,59)61-47-46-54-51(55)44-41-39-10-8-5-2/h7,9,12-13,15-16,18-19,21-22,50H,4-6,8,10-11,14,17,20,23-49H2,1-3H3,(H,54,55)(H,58,59)/b9-7-,13-12-,16-15-,19-18-,22-21-/t50-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4]/[CH:7]=[CH:9]\[CH2:11]/[CH:12]=[CH:13]\[CH2:14]/[CH:15]=[CH:16]\[CH2:17]/[CH:18]=[CH:19]\[CH2:20]/[CH:21]=[CH:22]\[CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][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][CH2:10][CH2:8][CH2:5][CH3:2])[OH:55])[O:63][C:53]([CH2:43][CH2:6][CH3:3])=[O:57] |
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