| Properties | Image |
|---|
| MNX_ID | MNXM335798 |
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| reference | slm:000237181 |
| formula | C63H118O6 |
| global charge | 0 |
| mol weight | 971.631 |
| InChIKey | RZYHOTBEESOCCZ-CSQFQFPGSA-N |
| InChI | InChI=1S/C63H118O6/c1-4-7-10-13-16-19-22-24-26-27-28-29-30-31-32-33-34-35-37-38-41-44-47-50-53-56-62(65)68-59-60(58-67-61(64)55-52-49-46-43-40-21-18-15-12-9-6-3)69-63(66)57-54-51-48-45-42-39-36-25-23-20-17-14-11-8-5-2/h15,18,20,23,60H,4-14,16-17,19,21-22,24-59H2,1-3H3/b18-15-,23-20-/t60-/m1/s1 |
| SMILES | CCCC/C=C\CCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCC/C=C\CCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C63H118O6/c1-4-7-10-13-16-19-22-24-26-27-28-29-30-31-32-33-34-35-37-38-41-44-47-50-53-56-62(65)68-59-60(58-67-61(64)55-52-49-46-43-40-21-18-15-12-9-6-3)69-63(66)57-54-51-48-45-42-39-36-25-23-20-17-14-11-8-5-2/h15,18,20,23,60H,4-14,16-17,19,21-22,24-59H2,1-3H3/b18-15-,23-20-/t60-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22][CH2:24][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:37][CH2:38][CH2:41][CH2:44][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][CH2:40][CH2:21]/[CH:18]=[CH:15]\[CH2:12][CH2:9][CH2:6][CH3:3])=[O:64])[O:69][C:63]([CH2:57][CH2:54][CH2:51][CH2:48][CH2:45][CH2:42][CH2:39][CH2:36][CH2:25]/[CH:23]=[CH:20]\[CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:66] |
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