| Properties | Image |
|---|
| MNX_ID | MNXM1196880 |
 |
| reference | envipathM:...d8e5d2f8cc38 |
| formula | C21H38O9 |
| global charge | 0 |
| mol weight | 434.526 |
| InChIKey | LNRKLSPXXIIERR-UHFFFAOYSA-N |
| InChI | InChI=1S/C21H38O9/c1-9-7-21(6,29)19(27)12(4)17(26)13(5)20(28)30-18(14(23)8-22)11(3)16(25)10(2)15(9)24/h10-14,16-19,22-27,29H,7-8H2,1-6H3 |
| SMILES | CC1=C(O)C(C)C(O)C(C)C(C(O)CO)OC(=O)C(C)C(O)C(C)C(O)C(C)(O)C1 |
MNX internals
| InChI (mnx) | InChI=1/C21H38O9/c1-9-7-21(6,29)19(27)12(4)17(26)13(5)20(28)30-18(14(23)8-22)11(3)16(25)10(2)15(9)24/h10-14,16-19,22-27,29H,7-8H2,1-6H3/b15-9?/t10?,11?,12?,13?,14?,16?,17?,18?,19?,21? |
 |
| SMILES (mnx) | [CH3:1][C:9]1=[C:15]([OH:24])[CH:10]([CH3:2])[CH:16]([OH:25])[CH:11]([CH3:3])[CH:18]([CH:14]([CH2:8][OH:22])[OH:23])[O:30][C:20](=[O:28])[CH:13]([CH3:5])[CH:17]([OH:26])[CH:12]([CH3:4])[CH:19]([OH:27])[C:21]([CH3:6])([OH:29])[CH2:7]1 |
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