| Properties | Image |
|---|
| MNX_ID | MNXM179593 |
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| reference | slm:000007764 |
| formula | C49H86NO8P |
| global charge | 0 |
| mol weight | 848.2 |
| InChIKey | DOSDZZADZYYQQI-RJOKZBIHSA-N |
| InChI | InChI=1S/C49H86NO8P/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-31-34-37-40-48(51)55-44-47(45-57-59(53,54)56-43-42-50(4,5)6)58-49(52)41-38-35-32-29-30-33-36-39-46(2)3/h8-9,11-12,14-15,17-18,20-21,23-24,46-47H,7,10,13,16,19,22,25-45H2,1-6H3/b9-8-,12-11-,15-14-,18-17-,21-20-,24-23-/t47-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCC(C)C |
MNX internals
| InChI (mnx) | InChI=1/C49H86NO8P/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-31-34-37-40-48(51)55-44-47(45-57-59(53,54)56-43-42-50(4,5)6)58-49(52)41-38-35-32-29-30-33-36-39-46(2)3/h8-9,11-12,14-15,17-18,20-21,23-24,46-47H,7,10,13,16,19,22,25-45H2,1-6H3/b9-8-,12-11-,15-14-,18-17-,21-20-,24-23-/t47-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:7]/[CH:8]=[CH:9]\[CH2:10]/[CH:11]=[CH:12]\[CH2:13]/[CH:14]=[CH:15]\[CH2:16]/[CH:17]=[CH:18]\[CH2:19]/[CH:20]=[CH:21]\[CH2:22]/[CH:23]=[CH:24]\[CH2:25][CH2:26][CH2:27][CH2:28][CH2:31][CH2:34][CH2:37][CH2:40][C:48](=[O:51])[O:55][CH2:44][C@H:47]([CH2:45][O:57][P:59](=[O:53])([O-:54])[O:56][CH2:43][CH2:42][N+:50]([CH3:4])([CH3:5])[CH3:6])[O:58][C:49]([CH2:41][CH2:38][CH2:35][CH2:32][CH2:29][CH2:30][CH2:33][CH2:36][CH2:39][CH:46]([CH3:2])[CH3:3])=[O:52] |
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