| Properties | Image |
|---|
| MNX_ID | MNXM360886 |
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| reference | slm:000490275 |
| formula | C61H109NO10P |
| global charge | -1 |
| mol weight | 1047.514 |
| InChIKey | FRWXXGZYURNTOO-HUEHLGHWSA-M |
| InChI | InChI=1S/C61H110NO10P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-39-41-43-45-47-49-51-53-60(64)72-57(55-70-73(67,68)71-56-58(62)61(65)66)54-69-59(63)52-50-48-46-44-42-40-18-16-14-12-10-8-6-4-2/h11,13,17,19,21-22,24-25,27-28,57-58H,3-10,12,14-16,18,20,23,26,29-56,62H2,1-2H3,(H,65,66)(H,67,68)/p-1/b13-11-,19-17-,22-21-,25-24-,28-27-/t57-,58+/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCC)COP(=O)([O-])OC[C@H]([NH3+])C(=O)[O-] |
MNX internals
| InChI (mnx) | InChI=1/C61H110NO10P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-39-41-43-45-47-49-51-53-60(64)72-57(55-70-73(67,68)71-56-58(62)61(65)66)54-69-59(63)52-50-48-46-44-42-40-18-16-14-12-10-8-6-4-2/h11,13,17,19,21-22,24-25,27-28,57-58H,3-10,12,14-16,18,20,23,26,29-56,62H2,1-2H3,(H,65,66)(H,67,68)/b13-11-,19-17-,22-21-,25-24-,28-27-/t57-,58+/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]\[CH2:20]/[CH:21]=[CH:22]\[CH2:23]/[CH:24]=[CH:25]\[CH2:26]/[CH:27]=[CH:28]\[CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH2:39][CH2:41][CH2:43][CH2:45][CH2:47][CH2:49][CH2:51][CH2:53][C:60](=[O:64])[O:72][C@H:57]([CH2:54][O:69][C:59]([CH2:52][CH2:50][CH2:48][CH2:46][CH2:44][CH2:42][CH2:40][CH2:18][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:63])[CH2:55][O:70][P:73]([OH:67])(=[O:68])[O:71][CH2:56][C@@H:58]([C:61](=[O:65])[OH:66])[NH2:62] |
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