| Properties | Image |
|---|
| MNX_ID | MNXM350898 |
 |
| reference | slm:000222980 |
| formula | C63H100O6 |
| global charge | 0 |
| mol weight | 953.487 |
| InChIKey | IZUCWLLAOFSNHD-GXEBAEMBSA-N |
| InChI | InChI=1S/C63H100O6/c1-4-7-10-13-16-19-21-23-25-27-29-31-33-35-37-39-41-44-47-50-53-56-62(65)68-59-60(58-67-61(64)55-52-49-46-43-18-15-12-9-6-3)69-63(66)57-54-51-48-45-42-40-38-36-34-32-30-28-26-24-22-20-17-14-11-8-5-2/h7,10,16-17,19-20,23-26,29-32,35-38,41-42,44-45,60H,4-6,8-9,11-15,18,21-22,27-28,33-34,39-40,43,46-59H2,1-3H3/b10-7-,19-16-,20-17-,25-23-,26-24-,31-29-,32-30-,37-35-,38-36-,44-41-,45-42-/t60-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)OC[C@@H](COC(=O)CCCCCCCCCCC)OC(=O)CCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C63H100O6/c1-4-7-10-13-16-19-21-23-25-27-29-31-33-35-37-39-41-44-47-50-53-56-62(65)68-59-60(58-67-61(64)55-52-49-46-43-18-15-12-9-6-3)69-63(66)57-54-51-48-45-42-40-38-36-34-32-30-28-26-24-22-20-17-14-11-8-5-2/h7,10,16-17,19-20,23-26,29-32,35-38,41-42,44-45,60H,4-6,8-9,11-15,18,21-22,27-28,33-34,39-40,43,46-59H2,1-3H3/b10-7-,19-16-,20-17-,25-23-,26-24-,31-29-,32-30-,37-35-,38-36-,44-41-,45-42-/t60-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:19]\[CH2:21]/[CH:23]=[CH:25]\[CH2:27]/[CH:29]=[CH:31]\[CH2:33]/[CH:35]=[CH:37]\[CH2:39]/[CH:41]=[CH:44]\[CH2:47][CH2:50][CH2:53][CH2:56][C:62](=[O:65])[O:68][CH2:59][C@@H:60]([CH2:58][O:67][C:61]([CH2:55][CH2:52][CH2:49][CH2:46][CH2:43][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:64])[O:69][C:63]([CH2:57][CH2:54][CH2:51][CH2:48]/[CH:45]=[CH:42]\[CH2:40]/[CH:38]=[CH:36]\[CH2:34]/[CH:32]=[CH:30]\[CH2:28]/[CH:26]=[CH:24]\[CH2:22]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:66] |
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