| Properties | Image |
|---|
| MNX_ID | MNXM1174444 |
 |
| reference | envipathM:...fe5f2a895038 |
| formula | C37H66O11 |
| global charge | 0 |
| mol weight | 686.924 |
| InChIKey | MTXGDDRSQWWCKT-UHFFFAOYSA-N |
| InChI | InChI=1S/C37H66O11/c1-2-3-21-32(42)33(43)26-35-34(48-35)22-13-5-4-6-14-23-36(44)46-28-31(27-39)47-37(45)24-15-8-7-10-17-29(40)18-11-9-12-19-30(41)20-16-25-38/h11-12,18-19,29-35,38-43H,2-10,13-17,20-28H2,1H3 |
| SMILES | CCCCC(O)C(O)CC1OC1CCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCC(O)C=CCC=CC(O)CCCO |
MNX internals
| InChI (mnx) | InChI=1/C37H66O11/c1-2-3-21-32(42)33(43)26-35-34(48-35)22-13-5-4-6-14-23-36(44)46-28-31(27-39)47-37(45)24-15-8-7-10-17-29(40)18-11-9-12-19-30(41)20-16-25-38/h11-12,18-19,29-35,38-43H,2-10,13-17,20-28H2,1H3/b18-11?,19-12?/t29?,30?,31?,32?,33?,34?,35? |
 |
| SMILES (mnx) | [CH3:1][CH2:2][CH2:3][CH2:21][CH:32]([CH:33]([CH2:26][CH:35]1[CH:34]([CH2:22][CH2:13][CH2:5][CH2:4][CH2:6][CH2:14][CH2:23][C:36](=[O:44])[O:46][CH2:28][CH:31]([CH2:27][OH:39])[O:47][C:37]([CH2:24][CH2:15][CH2:8][CH2:7][CH2:10][CH2:17][CH:29]([CH:18]=[CH:11][CH2:9][CH:12]=[CH:19][CH:30]([CH2:20][CH2:16][CH2:25][OH:38])[OH:41])[OH:40])=[O:45])[O:48]1)[OH:43])[OH:42] |
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