| Properties | Image |
|---|
| MNX_ID | MNXM1190543 |
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| reference | envipathM:...f8e5d44ba288 |
| formula | C37H62O8 |
| global charge | 0 |
| mol weight | 634.895 |
| InChIKey | WFFRTIACAZRKDF-UHFFFAOYSA-N |
| InChI | InChI=1S/C37H62O8/c1-3-5-7-9-10-11-12-13-14-15-16-18-22-26-33(40)37(42)44-31(29-38)30-43-35(41)28-24-20-19-21-25-32(39)36-34(45-36)27-23-17-8-6-4-2/h9-10,12-13,17,23,29,31-34,36,39-40H,3-8,11,14-16,18-22,24-28,30H2,1-2H3 |
| SMILES | CCCCC=CCC=CCCCCCCC(O)C(=O)OC(C=O)COC(=O)CCCCCCC(O)C1OC1CC=CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C37H62O8/c1-3-5-7-9-10-11-12-13-14-15-16-18-22-26-33(40)37(42)44-31(29-38)30-43-35(41)28-24-20-19-21-25-32(39)36-34(45-36)27-23-17-8-6-4-2/h9-10,12-13,17,23,29,31-34,36,39-40H,3-8,11,14-16,18-22,24-28,30H2,1-2H3/b10-9?,13-12?,23-17?/t31?,32?,33?,34?,36? |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH:9]=[CH:10][CH2:11][CH:12]=[CH:13][CH2:14][CH2:15][CH2:16][CH2:18][CH2:22][CH2:26][CH:33]([C:37](=[O:42])[O:44][CH:31]([CH:29]=[O:38])[CH2:30][O:43][C:35]([CH2:28][CH2:24][CH2:20][CH2:19][CH2:21][CH2:25][CH:32]([CH:36]1[CH:34]([CH2:27][CH:23]=[CH:17][CH2:8][CH2:6][CH2:4][CH3:2])[O:45]1)[OH:39])=[O:41])[OH:40] |
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