| Properties | Image |
|---|
| MNX_ID | MNXM219370 |
 |
| reference | slm:000256558 |
| formula | C66H112O6 |
| global charge | 0 |
| mol weight | 1001.616 |
| InChIKey | AKCXNPYNVGKWCE-QYRWNKLZSA-N |
| InChI | InChI=1S/C66H112O6/c1-5-7-9-11-13-15-17-19-21-23-25-26-28-30-32-34-38-43-47-51-55-59-66(69)72-63(61-71-65(68)58-54-50-46-42-39-35-36-40-44-48-52-56-62(3)4)60-70-64(67)57-53-49-45-41-37-33-31-29-27-24-22-20-18-16-14-12-10-8-6-2/h7,9,13-16,19-22,25-26,30,32,38,43,62-63H,5-6,8,10-12,17-18,23-24,27-29,31,33-37,39-42,44-61H2,1-4H3/b9-7-,15-13-,16-14-,21-19-,22-20-,26-25-,32-30-,43-38-/t63-/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)CCCCCCCCCCC/C=C\C/C=C\CCCCC)COC(=O)CCCCCCCCCCCCCC(C)C |
MNX internals
| InChI (mnx) | InChI=1/C66H112O6/c1-5-7-9-11-13-15-17-19-21-23-25-26-28-30-32-34-38-43-47-51-55-59-66(69)72-63(61-71-65(68)58-54-50-46-42-39-35-36-40-44-48-52-56-62(3)4)60-70-64(67)57-53-49-45-41-37-33-31-29-27-24-22-20-18-16-14-12-10-8-6-2/h7,9,13-16,19-22,25-26,30,32,38,43,62-63H,5-6,8,10-12,17-18,23-24,27-29,31,33-37,39-42,44-61H2,1-4H3/b9-7-,15-13-,16-14-,21-19-,22-20-,26-25-,32-30-,43-38-/t63-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:5]/[CH:7]=[CH:9]\[CH2:11]/[CH:13]=[CH:15]\[CH2:17]/[CH:19]=[CH:21]\[CH2:23]/[CH:25]=[CH:26]\[CH2:28]/[CH:30]=[CH:32]\[CH2:34]/[CH:38]=[CH:43]\[CH2:47][CH2:51][CH2:55][CH2:59][C:66](=[O:69])[O:72][C@H:63]([CH2:60][O:70][C:64]([CH2:57][CH2:53][CH2:49][CH2:45][CH2:41][CH2:37][CH2:33][CH2:31][CH2:29][CH2:27][CH2:24]/[CH:22]=[CH:20]\[CH2:18]/[CH:16]=[CH:14]\[CH2:12][CH2:10][CH2:8][CH2:6][CH3:2])=[O:67])[CH2:61][O:71][C:65]([CH2:58][CH2:54][CH2:50][CH2:46][CH2:42][CH2:39][CH2:35][CH2:36][CH2:40][CH2:44][CH2:48][CH2:52][CH2:56][CH:62]([CH3:3])[CH3:4])=[O:68] |
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