| Properties | Image |
|---|
| MNX_ID | MNXM957930 |
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| reference | slm:000650315 |
| formula | C71H123NO9P |
| global charge | -1 |
| mol weight | 1165.737 |
| InChIKey | ITLWOSNNEBWPTL-VUUOUKLKSA-M |
| InChI | InChI=1S/C71H124NO9P/c1-4-7-10-13-16-19-21-23-25-27-29-30-31-32-33-34-35-36-37-38-40-42-44-46-48-51-54-57-60-63-71(75)81-68(67-80-82(76,77)79-65-64-72-69(73)61-58-55-52-49-18-15-12-9-6-3)66-78-70(74)62-59-56-53-50-47-45-43-41-39-28-26-24-22-20-17-14-11-8-5-2/h7,10,16-17,19-20,23-26,29-30,32-33,39,41,68H,4-6,8-9,11-15,18,21-22,27-28,31,34-38,40,42-67H2,1-3H3,(H,72,73)(H,76,77)/p-1/b10-7-,19-16-,20-17-,25-23-,26-24-,30-29-,33-32-,41-39-/t68-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCC/C=C\C/C=C\C/C=C\CCCCC)COP(=O)([O-])OCCNC(=O)CCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C71H124NO9P/c1-4-7-10-13-16-19-21-23-25-27-29-30-31-32-33-34-35-36-37-38-40-42-44-46-48-51-54-57-60-63-71(75)81-68(67-80-82(76,77)79-65-64-72-69(73)61-58-55-52-49-18-15-12-9-6-3)66-78-70(74)62-59-56-53-50-47-45-43-41-39-28-26-24-22-20-17-14-11-8-5-2/h7,10,16-17,19-20,23-26,29-30,32-33,39,41,68H,4-6,8-9,11-15,18,21-22,27-28,31,34-38,40,42-67H2,1-3H3,(H,72,73)(H,76,77)/b10-7-,19-16-,20-17-,25-23-,26-24-,30-29-,33-32-,41-39-/t68-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:19]\[CH2:21]/[CH:23]=[CH:25]\[CH2:27]/[CH:29]=[CH:30]\[CH2:31]/[CH:32]=[CH:33]\[CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH2:40][CH2:42][CH2:44][CH2:46][CH2:48][CH2:51][CH2:54][CH2:57][CH2:60][CH2:63][C:71](=[O:75])[O:81][C@H:68]([CH2:66][O:78][C:70]([CH2:62][CH2:59][CH2:56][CH2:53][CH2:50][CH2:47][CH2:45][CH2:43]/[CH:41]=[CH:39]\[CH2:28]/[CH:26]=[CH:24]\[CH2:22]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:74])[CH2:67][O:80][P:82]([OH:76])(=[O:77])[O:79][CH2:65][CH2:64][N:72]=[C:69]([CH2:61][CH2:58][CH2:55][CH2:52][CH2:49][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[OH:73] |
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