| Properties | Image |
|---|
| MNX_ID | MNXM938940 |
 |
| reference | slm:000631325 |
| formula | C87H153NO9P |
| global charge | -1 |
| mol weight | 1388.153 |
| InChIKey | KMEGZEUMDQSFTP-KBMSTEOYSA-M |
| InChI | InChI=1S/C87H154NO9P/c1-4-7-10-13-16-19-22-25-28-31-33-35-37-38-39-40-41-42-43-44-45-46-48-49-51-54-57-60-63-66-69-72-75-78-86(90)94-82-84(97-87(91)79-76-73-70-67-64-61-58-55-52-50-47-36-34-32-29-26-23-20-17-14-11-8-5-2)83-96-98(92,93)95-81-80-88-85(89)77-74-71-68-65-62-59-56-53-30-27-24-21-18-15-12-9-6-3/h7,10,16,18-19,21,25,27-28,30,33,35,38-39,56,59,65,68,84H,4-6,8-9,11-15,17,20,22-24,26,29,31-32,34,36-37,40-55,57-58,60-64,66-67,69-83H2,1-3H3,(H,88,89)(H,92,93)/p-1/b10-7-,19-16-,21-18-,28-25-,30-27-,35-33-,39-38-,59-56-,68-65-/t84-/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)CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)OC(=O)CCCCCCCCCCCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C87H154NO9P/c1-4-7-10-13-16-19-22-25-28-31-33-35-37-38-39-40-41-42-43-44-45-46-48-49-51-54-57-60-63-66-69-72-75-78-86(90)94-82-84(97-87(91)79-76-73-70-67-64-61-58-55-52-50-47-36-34-32-29-26-23-20-17-14-11-8-5-2)83-96-98(92,93)95-81-80-88-85(89)77-74-71-68-65-62-59-56-53-30-27-24-21-18-15-12-9-6-3/h7,10,16,18-19,21,25,27-28,30,33,35,38-39,56,59,65,68,84H,4-6,8-9,11-15,17,20,22-24,26,29,31-32,34,36-37,40-55,57-58,60-64,66-67,69-83H2,1-3H3,(H,88,89)(H,92,93)/b10-7-,19-16-,21-18-,28-25-,30-27-,35-33-,39-38-,59-56-,68-65-/t84-/m1/s1 |
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| 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:33]=[CH:35]\[CH2:37]/[CH:38]=[CH:39]\[CH2:40][CH2:41][CH2:42][CH2:43][CH2:44][CH2:45][CH2:46][CH2:48][CH2:49][CH2:51][CH2:54][CH2:57][CH2:60][CH2:63][CH2:66][CH2:69][CH2:72][CH2:75][CH2:78][C:86](=[O:90])[O:94][CH2:82][C@H:84]([CH2:83][O:96][P:98]([OH:92])(=[O:93])[O:95][CH2:81][CH2:80][N:88]=[C:85]([CH2:77][CH2:74][CH2:71]/[CH:68]=[CH:65]\[CH2:62]/[CH:59]=[CH:56]\[CH2:53]/[CH:30]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[OH:89])[O:97][C:87]([CH2:79][CH2:76][CH2:73][CH2:70][CH2:67][CH2:64][CH2:61][CH2:58][CH2:55][CH2:52][CH2:50][CH2:47][CH2:36][CH2:34][CH2:32][CH2:29][CH2:26][CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:91] |
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