| Properties | Image |
|---|
| MNX_ID | MNXM105971 |
 |
| reference | chebi:68953 |
| formula | C26H38O9 |
| global charge | 0 |
| mol weight | 494.581 |
| InChIKey | IJXBJCLCYUSOPN-YRLDIHFHSA-N |
| InChI | InChI=1S/C26H38O9/c1-12(2)19-20-21(26(11-31-26)24(33-15(5)28)22(19)32-14(4)27)18-10-13(3)17(30)8-9-25(7,23(20)34-18)35-16(6)29/h12,17-24,30H,3,8-11H2,1-2,4-7H3/t17-,18+,19+,20+,21+,22-,23+,24-,25+,26+/m0/s1 |
| SMILES | C=C1C[C@H]2O[C@H]([C@@H]3[C@@H](C(C)C)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@]4(CO4)[C@@H]32)[C@](C)(OC(C)=O)CC[C@@H]1O |
MNX internals
| InChI (mnx) | InChI=1/C26H38O9/c1-12(2)19-20-21(26(11-31-26)24(33-15(5)28)22(19)32-14(4)27)18-10-13(3)17(30)8-9-25(7,23(20)34-18)35-16(6)29/h12,17-24,30H,3,8-11H2,1-2,4-7H3/t17-,18+,19+,20+,21+,22-,23+,24-,25+,26+/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][CH:12]([CH3:2])[C@@H:19]1[C@@H:20]2[C@@H:21]([C@H:18]3[CH2:10][C:13](=[CH2:3])[C@@H:17]([OH:30])[CH2:8][CH2:9][C@@:25]([CH3:7])([O:35][C:16]([CH3:6])=[O:29])[C@@H:23]2[O:34]3)[C@:26]2([CH2:11][O:31]2)[C@@H:24]([O:33][C:15]([CH3:5])=[O:28])[C@H:22]1[O:32][C:14]([CH3:4])=[O:27] |
|