| Properties | Image |
|---|
| MNX_ID | MNXM1179649 |
 |
| reference | envipathM:...80de0c267953 |
| formula | C37H66O12 |
| global charge | 0 |
| mol weight | 702.923 |
| InChIKey | UIHDJRJNBAAKGJ-UHFFFAOYSA-N |
| InChI | InChI=1S/C37H66O12/c1-2-3-4-6-12-20-30-31(48-30)21-13-10-9-11-19-29(41)37(45)47-26-27(39)25-46-33(42)23-15-8-5-7-14-22-32-36(49-32)35(44)34(43)28(40)18-16-17-24-38/h6,12,27-32,34-36,38-41,43-44H,2-5,7-11,13-26H2,1H3 |
| SMILES | CCCCC=CCC1OC1CCCCCCC(O)C(=O)OCC(O)COC(=O)CCCCCCCC1OC1C(O)C(O)C(O)CCCCO |
MNX internals
| InChI (mnx) | InChI=1/C37H66O12/c1-2-3-4-6-12-20-30-31(48-30)21-13-10-9-11-19-29(41)37(45)47-26-27(39)25-46-33(42)23-15-8-5-7-14-22-32-36(49-32)35(44)34(43)28(40)18-16-17-24-38/h6,12,27-32,34-36,38-41,43-44H,2-5,7-11,13-26H2,1H3/b12-6?/t27?,28?,29?,30?,31?,32?,34?,35?,36? |
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| SMILES (mnx) | [CH3:1][CH2:2][CH2:3][CH2:4][CH:6]=[CH:12][CH2:20][CH:30]1[CH:31]([CH2:21][CH2:13][CH2:10][CH2:9][CH2:11][CH2:19][CH:29]([C:37](=[O:45])[O:47][CH2:26][CH:27]([CH2:25][O:46][C:33]([CH2:23][CH2:15][CH2:8][CH2:5][CH2:7][CH2:14][CH2:22][CH:32]2[CH:36]([CH:35]([CH:34]([CH:28]([CH2:18][CH2:16][CH2:17][CH2:24][OH:38])[OH:40])[OH:43])[OH:44])[O:49]2)=[O:42])[OH:39])[OH:41])[O:48]1 |
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