| Properties | Image |
|---|
| MNX_ID | MNXM1173272 |
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| reference | envipathM:...e8e2e2fbd62c |
| formula | C37H64O10 |
| global charge | 0 |
| mol weight | 668.909 |
| InChIKey | NCOAPGJQGKKMLT-UHFFFAOYSA-N |
| InChI | InChI=1S/C37H64O10/c1-3-5-7-8-9-10-11-12-13-14-15-17-20-24-31(40)37(44)46-29(27-38)28-45-33(41)26-22-19-16-18-21-25-32-36(47-32)35(43)34(42)30(39)23-6-4-2/h8-9,11-12,29,31-32,34-36,38,40,42-43H,3-7,10,13-28H2,1-2H3 |
| SMILES | CCCCC=CCC=CCCCCCCC(O)C(=O)OC(CO)COC(=O)CCCCCCCC1OC1C(O)C(O)C(=O)CCCC |
MNX internals
| InChI (mnx) | InChI=1/C37H64O10/c1-3-5-7-8-9-10-11-12-13-14-15-17-20-24-31(40)37(44)46-29(27-38)28-45-33(41)26-22-19-16-18-21-25-32-36(47-32)35(43)34(42)30(39)23-6-4-2/h8-9,11-12,29,31-32,34-36,38,40,42-43H,3-7,10,13-28H2,1-2H3/b9-8?,12-11?/t29?,31?,32?,34?,35?,36? |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH:8]=[CH:9][CH2:10][CH:11]=[CH:12][CH2:13][CH2:14][CH2:15][CH2:17][CH2:20][CH2:24][CH:31]([C:37](=[O:44])[O:46][CH:29]([CH2:27][OH:38])[CH2:28][O:45][C:33]([CH2:26][CH2:22][CH2:19][CH2:16][CH2:18][CH2:21][CH2:25][CH:32]1[CH:36]([CH:35]([CH:34]([C:30]([CH2:23][CH2:6][CH2:4][CH3:2])=[O:39])[OH:42])[OH:43])[O:47]1)=[O:41])[OH:40] |
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