| Properties | Image |
| MNX_ID | MNXM107358 |
 |
| reference | chebi:66816 |
| formula | C24H30O8 |
| global charge | 0 |
| mol weight | 446.496 |
| InChIKey | VBJCSMQHVABALD-QUJPKXGGSA-N |
| InChI | InChI=1S/C24H30O8/c1-7-11(3)20(27)19-21(28)18-13(15(8-2)30-12(4)25)10-17(26)32-22(18)14-9-16(24(5,6)29)31-23(14)19/h10-11,15-16,28-29H,7-9H2,1-6H3/t11-,15-,16?/m0/s1 |
| SMILES | CC[C@H](OC(C)=O)C1=CC(=O)OC2=C3CC(C(C)(C)O)OC3=C(C(=O)[C@@H](C)CC)C(O)=C12 |
MNX internals
| InChI (mnx) | InChI=1/C24H30O8/c1-7-11(3)20(27)19-21(28)18-13(15(8-2)30-12(4)25)10-17(26)32-22(18)14-9-16(24(5,6)29)31-23(14)19/h10-11,15-16,28-29H,7-9H2,1-6H3/t11-,15-,16?/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:7][C@H:11]([CH3:3])[C:20]([C:19]1=[C:23]2[C:14](=[C:22]3[C:18](=[C:21]1[OH:28])[C:13]([C@H:15]([CH2:8][CH3:2])[O:30][C:12]([CH3:4])=[O:25])=[CH:10][C:17](=[O:26])[O:32]3)[CH2:9][CH:16]([C:24]([CH3:5])([CH3:6])[OH:29])[O:31]2)=[O:27] |
|