| Properties | Image |
|---|
| MNX_ID | MNXM954463 |
 |
| reference | slm:000646848 |
| formula | C71H111NO9P |
| global charge | -1 |
| mol weight | 1153.641 |
| InChIKey | DPQDMMCVOCJEIK-SVCXHCOYSA-M |
| InChI | InChI=1S/C71H112NO9P/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-52-55-58-61-69(73)72-64-65-79-82(76,77)80-67-68(81-71(75)63-60-57-54-51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)66-78-70(74)62-59-56-53-50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h7,9-10,12,16-21,25-30,34,36-37,39,43,45-46,48,52,54-55,57,68H,4-6,8,11,13-15,22-24,31-33,35,38,40-42,44,47,49-51,53,56,58-67H2,1-3H3,(H,72,73)(H,76,77)/p-1/b10-7-,12-9-,19-16-,20-17-,21-18-,28-25-,29-26-,30-27-,37-34-,39-36-,46-43-,48-45-,55-52-,57-54-/t68-/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](COC(=O)CCCCCCCCCCC/C=C\C/C=C\CCCCC)OC(=O)CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC |
MNX internals
| InChI (mnx) | InChI=1/C71H112NO9P/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-52-55-58-61-69(73)72-64-65-79-82(76,77)80-67-68(81-71(75)63-60-57-54-51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)66-78-70(74)62-59-56-53-50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h7,9-10,12,16-21,25-30,34,36-37,39,43,45-46,48,52,54-55,57,68H,4-6,8,11,13-15,22-24,31-33,35,38,40-42,44,47,49-51,53,56,58-67H2,1-3H3,(H,72,73)(H,76,77)/b10-7-,12-9-,19-16-,20-17-,21-18-,28-25-,29-26-,30-27-,37-34-,39-36-,46-43-,48-45-,55-52-,57-54-/t68-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:28]\[CH2:31]/[CH:34]=[CH:37]\[CH2:40]/[CH:43]=[CH:46]\[CH2:49]/[CH:52]=[CH:55]\[CH2:58][CH2:61][C:69](=[N:72][CH2:64][CH2:65][O:79][P:82]([OH:76])(=[O:77])[O:80][CH2:67][C@@H:68]([CH2:66][O:78][C:70]([CH2:62][CH2:59][CH2:56][CH2:53][CH2:50][CH2:47][CH2:44][CH2:41][CH2:38][CH2:35][CH2:32]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:74])[O:81][C:71]([CH2:63][CH2:60]/[CH:57]=[CH:54]\[CH2:51]/[CH:48]=[CH:45]\[CH2:42]/[CH:39]=[CH:36]\[CH2:33]/[CH:30]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15]/[CH:12]=[CH:9]\[CH2:6][CH3:3])=[O:75])[OH:73] |
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