| Properties | Image |
|---|
| MNX_ID | MNXM196020 |
 |
| reference | slm:000001800 |
| formula | C56H93NO10P |
| global charge | -1 |
| mol weight | 971.331 |
| InChIKey | IMUYPACSIYIKEK-HBDCAXHVSA-M |
| InChI | InChI=1S/C56H94NO10P/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-29-30-32-34-36-38-40-42-44-46-48-55(59)67-52(50-65-68(62,63)66-51-53(57)56(60)61)49-64-54(58)47-45-43-41-39-37-35-33-31-20-18-16-14-12-10-8-6-4-2/h6,8,11-14,17-20,22-23,25-26,28-29,52-53H,3-5,7,9-10,15-16,21,24,27,30-51,57H2,1-2H3,(H,60,61)(H,62,63)/p-1/b8-6-,13-11-,14-12-,19-17-,20-18-,23-22-,26-25-,29-28-/t52-,53+/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\CCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OC[C@H]([NH3+])C(=O)[O-])OC(=O)CCCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C56H94NO10P/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-29-30-32-34-36-38-40-42-44-46-48-55(59)67-52(50-65-68(62,63)66-51-53(57)56(60)61)49-64-54(58)47-45-43-41-39-37-35-33-31-20-18-16-14-12-10-8-6-4-2/h6,8,11-14,17-20,22-23,25-26,28-29,52-53H,3-5,7,9-10,15-16,21,24,27,30-51,57H2,1-2H3,(H,60,61)(H,62,63)/b8-6-,13-11-,14-12-,19-17-,20-18-,23-22-,26-25-,29-28-/t52-,53+/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:19]\[CH2:21]/[CH:22]=[CH:23]\[CH2:24]/[CH:25]=[CH:26]\[CH2:27]/[CH:28]=[CH:29]\[CH2:30][CH2:32][CH2:34][CH2:36][CH2:38][CH2:40][CH2:42][CH2:44][CH2:46][CH2:48][C:55](=[O:59])[O:67][C@H:52]([CH2:49][O:64][C:54]([CH2:47][CH2:45][CH2:43][CH2:41][CH2:39][CH2:37][CH2:35][CH2:33][CH2:31]/[CH:20]=[CH:18]\[CH2:16]/[CH:14]=[CH:12]\[CH2:10]/[CH:8]=[CH:6]\[CH2:4][CH3:2])=[O:58])[CH2:50][O:65][P:68]([OH:62])(=[O:63])[O:66][CH2:51][C@@H:53]([C:56](=[O:60])[OH:61])[NH2:57] |
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