| Properties | Image |
|---|
| MNX_ID | MNXM939140 |
 |
| reference | slm:000631525 |
| formula | C85H147NO9P |
| global charge | -1 |
| mol weight | 1358.083 |
| InChIKey | ZITGZENWJFFBKB-FXKGVNOOSA-M |
| InChI | InChI=1S/C85H148NO9P/c1-4-7-10-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-47-49-51-53-55-57-59-61-63-65-67-70-73-76-84(88)92-80-82(81-94-96(90,91)93-79-78-86-83(87)75-72-69-12-9-6-3)95-85(89)77-74-71-68-66-64-62-60-58-56-54-52-50-48-46-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-11-8-5-2/h7-8,10-11,15-18,21-24,27-30,33-36,82H,4-6,9,12-14,19-20,25-26,31-32,37-81H2,1-3H3,(H,86,87)(H,90,91)/p-1/b10-7-,11-8-,17-15-,18-16-,23-21-,24-22-,29-27-,30-28-,35-33-,36-34-/t82-/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)CCCCCCC)OC(=O)CCCCCCCCCCCCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC |
MNX internals
| InChI (mnx) | InChI=1/C85H148NO9P/c1-4-7-10-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-47-49-51-53-55-57-59-61-63-65-67-70-73-76-84(88)92-80-82(81-94-96(90,91)93-79-78-86-83(87)75-72-69-12-9-6-3)95-85(89)77-74-71-68-66-64-62-60-58-56-54-52-50-48-46-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-11-8-5-2/h7-8,10-11,15-18,21-24,27-30,33-36,82H,4-6,9,12-14,19-20,25-26,31-32,37-81H2,1-3H3,(H,86,87)(H,90,91)/b10-7-,11-8-,17-15-,18-16-,23-21-,24-22-,29-27-,30-28-,35-33-,36-34-/t82-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:15]=[CH:17]\[CH2:19]/[CH:21]=[CH:23]\[CH2:25]/[CH:27]=[CH:29]\[CH2:31]/[CH:33]=[CH:35]\[CH2:37][CH2:39][CH2:41][CH2:43][CH2:45][CH2:47][CH2:49][CH2:51][CH2:53][CH2:55][CH2:57][CH2:59][CH2:61][CH2:63][CH2:65][CH2:67][CH2:70][CH2:73][CH2:76][C:84](=[O:88])[O:92][CH2:80][C@H:82]([CH2:81][O:94][P:96]([OH:90])(=[O:91])[O:93][CH2:79][CH2:78][N:86]=[C:83]([CH2:75][CH2:72][CH2:69][CH2:12][CH2:9][CH2:6][CH3:3])[OH:87])[O:95][C:85]([CH2:77][CH2:74][CH2:71][CH2:68][CH2:66][CH2:64][CH2:62][CH2:60][CH2:58][CH2:56][CH2:54][CH2:52][CH2:50][CH2:48][CH2:46][CH2:44][CH2:42][CH2:40][CH2:38]/[CH:36]=[CH:34]\[CH2:32]/[CH:30]=[CH:28]\[CH2:26]/[CH:24]=[CH:22]\[CH2:20]/[CH:18]=[CH:16]\[CH2:14]/[CH:11]=[CH:8]\[CH2:5][CH3:2])=[O:89] |
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