| Properties | Image |
|---|
| MNX_ID | MNXM330119 |
 |
| reference | slm:000186691 |
| formula | C59H98O6 |
| global charge | 0 |
| mol weight | 903.427 |
| InChIKey | BOJINOUXFJQRQC-CJXSNPFZSA-N |
| InChI | InChI=1S/C59H98O6/c1-4-7-10-13-16-19-22-25-26-27-28-29-30-31-32-35-38-41-44-47-50-53-59(62)65-56(54-63-57(60)51-48-45-42-39-36-33-23-20-17-14-11-8-5-2)55-64-58(61)52-49-46-43-40-37-34-24-21-18-15-12-9-6-3/h7,10,16,19-20,23,25-26,28-29,31-32,37-38,40-41,56H,4-6,8-9,11-15,17-18,21-22,24,27,30,33-36,39,42-55H2,1-3H3/b10-7-,19-16-,23-20-,26-25-,29-28-,32-31-,40-37-,41-38-/t56-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)O[C@@H](COC(=O)CCCC/C=C\CCCCCCCCC)COC(=O)CCCCCCC/C=C\CCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C59H98O6/c1-4-7-10-13-16-19-22-25-26-27-28-29-30-31-32-35-38-41-44-47-50-53-59(62)65-56(54-63-57(60)51-48-45-42-39-36-33-23-20-17-14-11-8-5-2)55-64-58(61)52-49-46-43-40-37-34-24-21-18-15-12-9-6-3/h7,10,16,19-20,23,25-26,28-29,31-32,37-38,40-41,56H,4-6,8-9,11-15,17-18,21-22,24,27,30,33-36,39,42-55H2,1-3H3/b10-7-,19-16-,23-20-,26-25-,29-28-,32-31-,40-37-,41-38-/t56-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:26]\[CH2:27]/[CH:28]=[CH:29]\[CH2:30]/[CH:31]=[CH:32]\[CH2:35]/[CH:38]=[CH:41]\[CH2:44][CH2:47][CH2:50][CH2:53][C:59](=[O:62])[O:65][C@H:56]([CH2:54][O:63][C:57]([CH2:51][CH2:48][CH2:45][CH2:42][CH2:39][CH2:36][CH2:33]/[CH:23]=[CH:20]\[CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:60])[CH2:55][O:64][C:58]([CH2:52][CH2:49][CH2:46][CH2:43]/[CH:40]=[CH:37]\[CH2:34][CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:61] |
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