| Properties | Image |
|---|
| MNX_ID | MNXM191431 |
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| reference | slm:000121823 |
| formula | C41H70O5 |
| global charge | 0 |
| mol weight | 643.006 |
| InChIKey | SISOTSHTWKLHSX-MWJOZMSJSA-N |
| InChI | InChI=1S/C41H70O5/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-36-41(44)46-39(37-42)38-45-40(43)35-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h5,7,11,13-14,16-17,19,22,24,39,42H,3-4,6,8-10,12,15,18,20-21,23,25-38H2,1-2H3/b7-5-,13-11-,16-14+,19-17-,24-22-/t39-/m0/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCC(=O)O[C@@H](CO)COC(=O)CCCCCCCCC/C=C/CCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C41H70O5/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-36-41(44)46-39(37-42)38-45-40(43)35-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h5,7,11,13-14,16-17,19,22,24,39,42H,3-4,6,8-10,12,15,18,20-21,23,25-38H2,1-2H3/b7-5-,13-11-,16-14+,19-17-,24-22-/t39-/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3]/[CH:5]=[CH:7]\[CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:19]\[CH2:20]/[CH:22]=[CH:24]\[CH2:26][CH2:28][CH2:30][CH2:32][CH2:34][CH2:36][C:41](=[O:44])[O:46][C@@H:39]([CH2:37][OH:42])[CH2:38][O:45][C:40]([CH2:35][CH2:33][CH2:31][CH2:29][CH2:27][CH2:25][CH2:23][CH2:21][CH2:18]/[CH:16]=[CH:14]/[CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:43] |
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