| Properties | Image |
|---|
| MNX_ID | MNXM1192799 |
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| reference | envipathM:...823d0b35b405 |
| formula | C37H66O9 |
| global charge | 0 |
| mol weight | 654.926 |
| InChIKey | KPIOZQHEXCROSD-UHFFFAOYSA-N |
| InChI | InChI=1S/C37H66O9/c1-2-3-4-5-6-7-8-9-10-11-12-14-19-25-33(41)37(43)45-31(29-39)30-44-36(42)32(40)24-20-16-17-22-27-35-34(46-35)26-21-15-13-18-23-28-38/h5-6,15,21,31-35,38-41H,2-4,7-14,16-20,22-30H2,1H3 |
| SMILES | CCCCC=CCCCCCCCCCC(O)C(=O)OC(CO)COC(=O)C(O)CCCCCCC1OC1CC=CCCCCO |
MNX internals
| InChI (mnx) | InChI=1/C37H66O9/c1-2-3-4-5-6-7-8-9-10-11-12-14-19-25-33(41)37(43)45-31(29-39)30-44-36(42)32(40)24-20-16-17-22-27-35-34(46-35)26-21-15-13-18-23-28-38/h5-6,15,21,31-35,38-41H,2-4,7-14,16-20,22-30H2,1H3/b6-5?,21-15?/t31?,32?,33?,34?,35? |
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| SMILES (mnx) | [CH3:1][CH2:2][CH2:3][CH2:4][CH:5]=[CH:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:14][CH2:19][CH2:25][CH:33]([C:37](=[O:43])[O:45][CH:31]([CH2:29][OH:39])[CH2:30][O:44][C:36]([CH:32]([CH2:24][CH2:20][CH2:16][CH2:17][CH2:22][CH2:27][CH:35]1[CH:34]([CH2:26][CH:21]=[CH:15][CH2:13][CH2:18][CH2:23][CH2:28][OH:38])[O:46]1)[OH:40])=[O:42])[OH:41] |
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