| Properties | Image |
|---|
| MNX_ID | MNXM1194481 |
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| reference | envipathM:...c613c4df4593 |
| formula | C37H62O10 |
| global charge | 0 |
| mol weight | 666.893 |
| InChIKey | PWFQOEYOOQSHSZ-UHFFFAOYSA-N |
| InChI | InChI=1S/C37H62O10/c1-2-3-4-7-12-19-30(40)31(41)20-13-8-5-10-15-23-36(42)44-27-29(39)28-45-37(43)24-16-11-6-9-14-21-32-34(46-32)26-35-33(47-35)22-17-18-25-38/h7,12,29,32-35,38-39H,2-6,8-11,13-28H2,1H3 |
| SMILES | CCCCC=CCC(=O)C(=O)CCCCCCCC(=O)OCC(O)COC(=O)CCCCCCCC1OC1CC1OC1CCCCO |
MNX internals
| InChI (mnx) | InChI=1/C37H62O10/c1-2-3-4-7-12-19-30(40)31(41)20-13-8-5-10-15-23-36(42)44-27-29(39)28-45-37(43)24-16-11-6-9-14-21-32-34(46-32)26-35-33(47-35)22-17-18-25-38/h7,12,29,32-35,38-39H,2-6,8-11,13-28H2,1H3/b12-7?/t29?,32?,33?,34?,35? |
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| SMILES (mnx) | [CH3:1][CH2:2][CH2:3][CH2:4][CH:7]=[CH:12][CH2:19][C:30]([C:31]([CH2:20][CH2:13][CH2:8][CH2:5][CH2:10][CH2:15][CH2:23][C:36](=[O:42])[O:44][CH2:27][CH:29]([CH2:28][O:45][C:37]([CH2:24][CH2:16][CH2:11][CH2:6][CH2:9][CH2:14][CH2:21][CH:32]1[CH:34]([CH2:26][CH:35]2[CH:33]([CH2:22][CH2:17][CH2:18][CH2:25][OH:38])[O:47]2)[O:46]1)=[O:43])[OH:39])=[O:41])=[O:40] |
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