| Properties | Image |
|---|
| MNX_ID | MNXM1047399 |
 |
| reference | slm:000739788 |
| formula | C51H85NO8P |
| global charge | -1 |
| mol weight | 871.214 |
| InChIKey | VNTASYGHWCXCLL-XPMACSHFSA-M |
| InChI | InChI=1S/C51H86NO8P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-30-32-34-36-38-40-42-44-51(55)58-47-49(53)48-60-61(56,57)59-46-45-52-50(54)43-41-39-37-35-33-31-29-18-16-14-12-10-8-6-4-2/h5,7,11-14,17-19,21-22,24-25,27-29,49,53H,3-4,6,8-10,15-16,20,23,26,30-48H2,1-2H3,(H,52,54)(H,56,57)/p-1/b7-5-,13-11-,14-12-,19-17-,22-21-,25-24-,28-27-,29-18-/t49-/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](O)COP(=O)([O-])OCCNC(=O)CCCCCCC/C=C\C/C=C\CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C51H86NO8P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-30-32-34-36-38-40-42-44-51(55)58-47-49(53)48-60-61(56,57)59-46-45-52-50(54)43-41-39-37-35-33-31-29-18-16-14-12-10-8-6-4-2/h5,7,11-14,17-19,21-22,24-25,27-29,49,53H,3-4,6,8-10,15-16,20,23,26,30-48H2,1-2H3,(H,52,54)(H,56,57)/b7-5-,13-11-,14-12-,19-17-,22-21-,25-24-,28-27-,29-18-/t49-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3]/[CH:5]=[CH:7]\[CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:19]\[CH2:20]/[CH:21]=[CH:22]\[CH2:23]/[CH:24]=[CH:25]\[CH2:26]/[CH:27]=[CH:28]\[CH2:30][CH2:32][CH2:34][CH2:36][CH2:38][CH2:40][CH2:42][CH2:44][C:51](=[O:55])[O:58][CH2:47][C@H:49]([CH2:48][O:60][P:61]([OH:56])(=[O:57])[O:59][CH2:46][CH2:45][N:52]=[C:50]([CH2:43][CH2:41][CH2:39][CH2:37][CH2:35][CH2:33][CH2:31]/[CH:29]=[CH:18]\[CH2:16]/[CH:14]=[CH:12]\[CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])[OH:54])[OH:53] |
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