| Properties | Image |
|---|
| MNX_ID | MNXM938777 |
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| reference | slm:000631162 |
| formula | C55H97NO9P |
| global charge | -1 |
| mol weight | 947.353 |
| InChIKey | JQRUYVUNAVNVSJ-JBTVAOEZSA-M |
| InChI | InChI=1S/C55H98NO9P/c1-4-7-9-11-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-40-42-44-47-54(58)62-50-52(65-55(59)45-6-3)51-64-66(60,61)63-49-48-56-53(57)46-43-41-39-12-10-8-5-2/h7,9,13-14,16-17,19-20,22-23,52H,4-6,8,10-12,15,18,21,24-51H2,1-3H3,(H,56,57)(H,60,61)/p-1/b9-7-,14-13-,17-16-,20-19-,23-22-/t52-/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)CCCCCCCCC)OC(=O)CCC |
MNX internals
| InChI (mnx) | InChI=1/C55H98NO9P/c1-4-7-9-11-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-40-42-44-47-54(58)62-50-52(65-55(59)45-6-3)51-64-66(60,61)63-49-48-56-53(57)46-43-41-39-12-10-8-5-2/h7,9,13-14,16-17,19-20,22-23,52H,4-6,8,10-12,15,18,21,24-51H2,1-3H3,(H,56,57)(H,60,61)/b9-7-,14-13-,17-16-,20-19-,23-22-/t52-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4]/[CH:7]=[CH:9]\[CH2:11]/[CH:13]=[CH:14]\[CH2:15]/[CH:16]=[CH:17]\[CH2:18]/[CH:19]=[CH:20]\[CH2:21]/[CH:22]=[CH: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][CH2:44][CH2:47][C:54](=[O:58])[O:62][CH2:50][C@H:52]([CH2:51][O:64][P:66]([OH:60])(=[O:61])[O:63][CH2:49][CH2:48][N:56]=[C:53]([CH2:46][CH2:43][CH2:41][CH2:39][CH2:12][CH2:10][CH2:8][CH2:5][CH3:2])[OH:57])[O:65][C:55]([CH2:45][CH2:6][CH3:3])=[O:59] |
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