| Properties | Image |
|---|
| MNX_ID | MNXM1023291 |
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| reference | slm:000715680 |
| formula | C64H111NO8P |
| global charge | -1 |
| mol weight | 1053.565 |
| InChIKey | DSKMRPIBIRXZAT-GPBBPMAASA-M |
| InChI | InChI=1S/C64H112NO8P/c1-4-7-10-13-16-19-22-25-27-29-31-33-35-37-39-42-45-48-51-54-58-70-60-62(73-64(67)56-53-50-47-44-41-24-21-18-15-12-9-6-3)61-72-74(68,69)71-59-57-65-63(66)55-52-49-46-43-40-38-36-34-32-30-28-26-23-20-17-14-11-8-5-2/h8,11,17,20,25-28,32,34,38,40,46,49,54,58,62H,4-7,9-10,12-16,18-19,21-24,29-31,33,35-37,39,41-45,47-48,50-53,55-57,59-61H2,1-3H3,(H,65,66)(H,68,69)/p-1/b11-8-,20-17-,27-25-,28-26-,34-32-,40-38-,49-46-,58-54-/t62-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)NCCOP(=O)([O-])OC[C@@H](CO/C=C\CCCCCCCCCC/C=C\CCCCCCCC)OC(=O)CCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C64H112NO8P/c1-4-7-10-13-16-19-22-25-27-29-31-33-35-37-39-42-45-48-51-54-58-70-60-62(73-64(67)56-53-50-47-44-41-24-21-18-15-12-9-6-3)61-72-74(68,69)71-59-57-65-63(66)55-52-49-46-43-40-38-36-34-32-30-28-26-23-20-17-14-11-8-5-2/h8,11,17,20,25-28,32,34,38,40,46,49,54,58,62H,4-7,9-10,12-16,18-19,21-24,29-31,33,35-37,39,41-45,47-48,50-53,55-57,59-61H2,1-3H3,(H,65,66)(H,68,69)/b11-8-,20-17-,27-25-,28-26-,34-32-,40-38-,49-46-,58-54-/t62-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22]/[CH:25]=[CH:27]\[CH2:29][CH2:31][CH2:33][CH2:35][CH2:37][CH2:39][CH2:42][CH2:45][CH2:48][CH2:51]/[CH:54]=[CH:58]\[O:70][CH2:60][C@H:62]([CH2:61][O:72][P:74]([OH:68])(=[O:69])[O:71][CH2:59][CH2:57][N:65]=[C:63]([CH2:55][CH2:52]/[CH:49]=[CH:46]\[CH2:43]/[CH:40]=[CH:38]\[CH2:36]/[CH:34]=[CH:32]\[CH2:30]/[CH:28]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14]/[CH:11]=[CH:8]\[CH2:5][CH3:2])[OH:66])[O:73][C:64]([CH2:56][CH2:53][CH2:50][CH2:47][CH2:44][CH2:41][CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:67] |
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