| Properties | Image |
|---|
| MNX_ID | MNXM938366 |
 |
| reference | slm:000630751 |
| formula | C83H135NO9P |
| global charge | -1 |
| mol weight | 1321.965 |
| InChIKey | MUNOIHJZBXTCMJ-ZMJGSAAWSA-M |
| InChI | InChI=1S/C83H136NO9P/c1-4-7-10-13-16-19-22-25-28-31-33-35-36-37-38-39-40-41-42-43-44-46-47-50-53-56-59-62-65-68-71-74-82(86)90-78-80(93-83(87)75-72-69-66-63-60-57-54-51-48-45-34-32-29-26-23-20-17-14-11-8-5-2)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/h7,10,16-21,25-30,33-35,37-38,45,51-52,54-55,60-61,63-64,80H,4-6,8-9,11-15,22-24,31-32,36,39-44,46-50,53,56-59,62,65-79H2,1-3H3,(H,84,85)(H,88,89)/p-1/b10-7-,19-16-,20-17-,21-18-,28-25-,29-26-,30-27-,35-33-,38-37-,45-34-,54-51-,55-52-,63-60-,64-61-/t80-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCCNC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)OC(=O)CCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C83H136NO9P/c1-4-7-10-13-16-19-22-25-28-31-33-35-36-37-38-39-40-41-42-43-44-46-47-50-53-56-59-62-65-68-71-74-82(86)90-78-80(93-83(87)75-72-69-66-63-60-57-54-51-48-45-34-32-29-26-23-20-17-14-11-8-5-2)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/h7,10,16-21,25-30,33-35,37-38,45,51-52,54-55,60-61,63-64,80H,4-6,8-9,11-15,22-24,31-32,36,39-44,46-50,53,56-59,62,65-79H2,1-3H3,(H,84,85)(H,88,89)/b10-7-,19-16-,20-17-,21-18-,28-25-,29-26-,30-27-,35-33-,38-37-,45-34-,54-51-,55-52-,63-60-,64-61-/t80-/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]\[CH2:36]/[CH:37]=[CH:38]\[CH2:39][CH2:40][CH2:41][CH2:42][CH2:43][CH2:44][CH2:46][CH2:47][CH2:50][CH2:53][CH2:56][CH2:59][CH2:62][CH2:65][CH2:68][CH2:71][CH2:74][C:82](=[O:86])[O:90][CH2:78][C@H:80]([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])[O:93][C:83]([CH2:75][CH2:72][CH2:69][CH2:66]/[CH:63]=[CH:60]\[CH2:57]/[CH:54]=[CH:51]\[CH2:48]/[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:87] |
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