| Properties | Image |
|---|
| MNX_ID | MNXM965173 |
 |
| reference | slm:000657558 |
| formula | C75H123NO9P |
| global charge | -1 |
| mol weight | 1213.781 |
| InChIKey | HDWIHUIWFZDQQR-WJPVUXONSA-M |
| InChI | InChI=1S/C75H124NO9P/c1-4-7-10-13-16-19-22-25-28-30-32-33-34-35-36-37-38-39-41-43-46-48-51-54-57-60-63-66-74(78)82-70-72(85-75(79)67-64-61-58-55-52-49-44-27-24-21-18-15-12-9-6-3)71-84-86(80,81)83-69-68-76-73(77)65-62-59-56-53-50-47-45-42-40-31-29-26-23-20-17-14-11-8-5-2/h8,11,16-21,25-29,32-33,35-36,40,42,44,47,50,56,59,72H,4-7,9-10,12-15,22-24,30-31,34,37-39,41,43,45-46,48-49,51-55,57-58,60-71H2,1-3H3,(H,76,77)(H,80,81)/p-1/b11-8-,19-16-,20-17-,21-18-,28-25-,29-26-,33-32-,36-35-,42-40-,44-27-,50-47-,59-56-/t72-/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)CCCCCCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)OC(=O)CCCCCCC/C=C\C/C=C\CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C75H124NO9P/c1-4-7-10-13-16-19-22-25-28-30-32-33-34-35-36-37-38-39-41-43-46-48-51-54-57-60-63-66-74(78)82-70-72(85-75(79)67-64-61-58-55-52-49-44-27-24-21-18-15-12-9-6-3)71-84-86(80,81)83-69-68-76-73(77)65-62-59-56-53-50-47-45-42-40-31-29-26-23-20-17-14-11-8-5-2/h8,11,16-21,25-29,32-33,35-36,40,42,44,47,50,56,59,72H,4-7,9-10,12-15,22-24,30-31,34,37-39,41,43,45-46,48-49,51-55,57-58,60-71H2,1-3H3,(H,76,77)(H,80,81)/b11-8-,19-16-,20-17-,21-18-,28-25-,29-26-,33-32-,36-35-,42-40-,44-27-,50-47-,59-56-/t72-/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]\[CH2:30]/[CH:32]=[CH:33]\[CH2:34]/[CH:35]=[CH:36]\[CH2:37][CH2:38][CH2:39][CH2:41][CH2:43][CH2:46][CH2:48][CH2:51][CH2:54][CH2:57][CH2:60][CH2:63][CH2:66][C:74](=[O:78])[O:82][CH2:70][C@H:72]([CH2:71][O:84][P:86]([OH:80])(=[O:81])[O:83][CH2:69][CH2:68][N:76]=[C:73]([CH2:65][CH2:62]/[CH:59]=[CH:56]\[CH2:53]/[CH:50]=[CH:47]\[CH2:45]/[CH:42]=[CH:40]\[CH2:31]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14]/[CH:11]=[CH:8]\[CH2:5][CH3:2])[OH:77])[O:85][C:75]([CH2:67][CH2:64][CH2:61][CH2:58][CH2:55][CH2:52][CH2:49]/[CH:44]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:79] |
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