| Properties | Image |
|---|
| MNX_ID | MNXM939153 |
 |
| reference | slm:000631538 |
| formula | C85H147NO9P |
| global charge | -1 |
| mol weight | 1358.083 |
| InChIKey | LHHLLILFLZZWKI-JONISHFKSA-M |
| InChI | InChI=1S/C85H148NO9P/c1-4-7-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-40-41-43-45-47-49-51-53-55-57-59-61-63-65-67-69-71-74-77-85(89)95-82(81-94-96(90,91)93-79-78-86-83(87)75-72-9-6-3)80-92-84(88)76-73-70-68-66-64-62-60-58-56-54-52-50-48-46-44-42-39-37-35-33-31-29-27-25-23-21-19-17-15-13-11-8-5-2/h7-8,10-11,14-17,20-23,26-29,32-35,82H,4-6,9,12-13,18-19,24-25,30-31,36-81H2,1-3H3,(H,86,87)(H,90,91)/p-1/b10-7-,11-8-,16-14-,17-15-,22-20-,23-21-,28-26-,29-27-,34-32-,35-33-/t82-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)COP(=O)([O-])OCCNC(=O)CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C85H148NO9P/c1-4-7-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-40-41-43-45-47-49-51-53-55-57-59-61-63-65-67-69-71-74-77-85(89)95-82(81-94-96(90,91)93-79-78-86-83(87)75-72-9-6-3)80-92-84(88)76-73-70-68-66-64-62-60-58-56-54-52-50-48-46-44-42-39-37-35-33-31-29-27-25-23-21-19-17-15-13-11-8-5-2/h7-8,10-11,14-17,20-23,26-29,32-35,82H,4-6,9,12-13,18-19,24-25,30-31,36-81H2,1-3H3,(H,86,87)(H,90,91)/b10-7-,11-8-,16-14-,17-15-,22-20-,23-21-,28-26-,29-27-,34-32-,35-33-/t82-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:12]/[CH:14]=[CH:16]\[CH2:18]/[CH:20]=[CH:22]\[CH2:24]/[CH:26]=[CH:28]\[CH2:30]/[CH:32]=[CH:34]\[CH2:36][CH2:38][CH2:40][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][CH2:69][CH2:71][CH2:74][CH2:77][C:85](=[O:89])[O:95][C@H:82]([CH2:80][O:92][C:84]([CH2:76][CH2:73][CH2:70][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][CH2:39][CH2:37]/[CH:35]=[CH:33]\[CH2:31]/[CH:29]=[CH:27]\[CH2:25]/[CH:23]=[CH:21]\[CH2:19]/[CH:17]=[CH:15]\[CH2:13]/[CH:11]=[CH:8]\[CH2:5][CH3:2])=[O:88])[CH2:81][O:94][P:96]([OH:90])(=[O:91])[O:93][CH2:79][CH2:78][N:86]=[C:83]([CH2:75][CH2:72][CH2:9][CH2:6][CH3:3])[OH:87] |
|