| Properties | Image |
|---|
| MNX_ID | MNXM30819 |
 |
| reference | chebi:62594 |
| formula | C88H174O4 |
| global charge | 0 |
| mol weight | 1296.356 |
| InChIKey | WKMCKGUOFOKHPR-DYTYEKQISA-N |
| InChI | InChI=1S/C88H174O4/c1-6-8-10-12-14-16-18-20-22-24-25-26-27-28-29-34-41-47-53-59-65-71-77-84(88(90)91)86(89)78-72-66-60-54-48-42-35-31-30-33-40-46-52-58-64-70-76-83-80-85(83)81(3)74-68-62-56-50-44-38-36-37-43-49-55-61-67-73-79-87(92-5)82(4)75-69-63-57-51-45-39-32-23-21-19-17-15-13-11-9-7-2/h81-87,89H,6-80H2,1-5H3,(H,90,91)/t81-,82+,83-,84-,85-,86-,87+/m1/s1 |
| SMILES | CCCCCCCCCCCCCCCCCCCCCCCC[C@@H](C(=O)O)[C@H](O)CCCCCCCCCCCCCCCCCC[C@@H]1C[C@@H]1[C@H](C)CCCCCCCCCCCCCCCC[C@H](OC)[C@@H](C)CCCCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C88H174O4/c1-6-8-10-12-14-16-18-20-22-24-25-26-27-28-29-34-41-47-53-59-65-71-77-84(88(90)91)86(89)78-72-66-60-54-48-42-35-31-30-33-40-46-52-58-64-70-76-83-80-85(83)81(3)74-68-62-56-50-44-38-36-37-43-49-55-61-67-73-79-87(92-5)82(4)75-69-63-57-51-45-39-32-23-21-19-17-15-13-11-9-7-2/h81-87,89H,6-80H2,1-5H3,(H,90,91)/t81-,82+,83-,84-,85-,86-,87+/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:6][CH2:8][CH2:10][CH2:12][CH2:14][CH2:16][CH2:18][CH2:20][CH2:22][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:34][CH2:41][CH2:47][CH2:53][CH2:59][CH2:65][CH2:71][CH2:77][C@H:84]([C@@H:86]([CH2:78][CH2:72][CH2:66][CH2:60][CH2:54][CH2:48][CH2:42][CH2:35][CH2:31][CH2:30][CH2:33][CH2:40][CH2:46][CH2:52][CH2:58][CH2:64][CH2:70][CH2:76][C@@H:83]1[CH2:80][C@@H:85]1[C@H:81]([CH3:3])[CH2:74][CH2:68][CH2:62][CH2:56][CH2:50][CH2:44][CH2:38][CH2:36][CH2:37][CH2:43][CH2:49][CH2:55][CH2:61][CH2:67][CH2:73][CH2:79][C@@H:87]([C@@H:82]([CH3:4])[CH2:75][CH2:69][CH2:63][CH2:57][CH2:51][CH2:45][CH2:39][CH2:32][CH2:23][CH2:21][CH2:19][CH2:17][CH2:15][CH2:13][CH2:11][CH2:9][CH2:7][CH3:2])[O:92][CH3:5])[OH:89])[C:88](=[O:90])[OH:91] |
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