| Properties | Image |
|---|
| MNX_ID | MNXM1192074 |
 |
| reference | envipathM:...86b669852ff8 |
| formula | C37H70O11 |
| global charge | 0 |
| mol weight | 690.956 |
| InChIKey | PSPMSDNULYHLAG-UHFFFAOYSA-N |
| InChI | InChI=1S/C37H70O11/c1-2-3-22-34-35(48-34)26-33(43)32(42)21-15-8-5-11-17-24-37(45)47-28-29(39)27-46-36(44)23-16-10-4-7-13-19-30(40)31(41)20-14-9-6-12-18-25-38/h29-35,38-43H,2-28H2,1H3 |
| SMILES | CCCCC1OC1CC(O)C(O)CCCCCCCC(=O)OCC(O)COC(=O)CCCCCCCC(O)C(O)CCCCCCCO |
MNX internals
| InChI (mnx) | InChI=1/C37H70O11/c1-2-3-22-34-35(48-34)26-33(43)32(42)21-15-8-5-11-17-24-37(45)47-28-29(39)27-46-36(44)23-16-10-4-7-13-19-30(40)31(41)20-14-9-6-12-18-25-38/h29-35,38-43H,2-28H2,1H3/t29?,30?,31?,32?,33?,34?,35? |
 |
| SMILES (mnx) | [CH3:1][CH2:2][CH2:3][CH2:22][CH:34]1[CH:35]([CH2:26][CH:33]([CH:32]([CH2:21][CH2:15][CH2:8][CH2:5][CH2:11][CH2:17][CH2:24][C:37](=[O:45])[O:47][CH2:28][CH:29]([CH2:27][O:46][C:36]([CH2:23][CH2:16][CH2:10][CH2:4][CH2:7][CH2:13][CH2:19][CH:30]([CH:31]([CH2:20][CH2:14][CH2:9][CH2:6][CH2:12][CH2:18][CH2:25][OH:38])[OH:41])[OH:40])=[O:44])[OH:39])[OH:42])[OH:43])[O:48]1 |
|