| Properties | Image |
|---|
| MNX_ID | MNXM962236 |
 |
| reference | slm:000654621 |
| formula | C83H137NO9P |
| global charge | -1 |
| mol weight | 1323.981 |
| InChIKey | XZODCADLXNYAPN-ATYNSKOKSA-M |
| InChI | InChI=1S/C83H138NO9P/c1-4-7-10-13-16-19-22-25-28-31-33-35-36-37-38-39-40-41-42-43-44-46-48-51-54-57-60-63-66-69-72-75-83(87)93-80(78-90-82(86)74-71-68-65-62-59-56-53-50-47-45-34-32-29-26-23-20-17-14-11-8-5-2)79-92-94(88,89)91-77-76-84-81(85)73-70-67-64-61-58-55-52-49-30-27-24-21-18-15-12-9-6-3/h16-21,25-30,33-35,37-38,40-41,45,50,52-53,55,61,64,80H,4-15,22-24,31-32,36,39,42-44,46-49,51,54,56-60,62-63,65-79H2,1-3H3,(H,84,85)(H,88,89)/p-1/b19-16-,20-17-,21-18-,28-25-,29-26-,30-27-,35-33-,38-37-,41-40-,45-34-,53-50-,55-52-,64-61-/t80-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)COP(=O)([O-])OCCNC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C83H138NO9P/c1-4-7-10-13-16-19-22-25-28-31-33-35-36-37-38-39-40-41-42-43-44-46-48-51-54-57-60-63-66-69-72-75-83(87)93-80(78-90-82(86)74-71-68-65-62-59-56-53-50-47-45-34-32-29-26-23-20-17-14-11-8-5-2)79-92-94(88,89)91-77-76-84-81(85)73-70-67-64-61-58-55-52-49-30-27-24-21-18-15-12-9-6-3/h16-21,25-30,33-35,37-38,40-41,45,50,52-53,55,61,64,80H,4-15,22-24,31-32,36,39,42-44,46-49,51,54,56-60,62-63,65-79H2,1-3H3,(H,84,85)(H,88,89)/b19-16-,20-17-,21-18-,28-25-,29-26-,30-27-,35-33-,38-37-,41-40-,45-34-,53-50-,55-52-,64-61-/t80-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:28]\[CH2:31]/[CH:33]=[CH:35]\[CH2:36]/[CH:37]=[CH:38]\[CH2:39]/[CH:40]=[CH:41]\[CH2:42][CH2:43][CH2:44][CH2:46][CH2:48][CH2:51][CH2:54][CH2:57][CH2:60][CH2:63][CH2:66][CH2:69][CH2:72][CH2:75][C:83](=[O:87])[O:93][C@H:80]([CH2:78][O:90][C:82]([CH2:74][CH2:71][CH2:68][CH2:65][CH2:62][CH2:59][CH2:56]/[CH:53]=[CH:50]\[CH2:47]/[CH:45]=[CH:34]\[CH2:32]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:86])[CH2:79][O:92][P:94]([OH:88])(=[O:89])[O:91][CH2:77][CH2:76][N:84]=[C:81]([CH2:73][CH2:70][CH2:67]/[CH:64]=[CH:61]\[CH2:58]/[CH:55]=[CH:52]\[CH2:49]/[CH:30]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[OH:85] |
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