| Properties | Image |
|---|
| MNX_ID | MNXM105819 |
 |
| reference | chebi:67452 |
| formula | C23H28O7 |
| global charge | 0 |
| mol weight | 416.47 |
| InChIKey | YVMJUSKDPJGDHW-HNYWDRBLSA-N |
| InChI | InChI=1S/C23H28O7/c1-11-7-13-8-15(25-3)20(26-4)22(27-5)17(13)18-14(19(24)12(11)2)9-16-21(23(18)28-6)30-10-29-16/h8-9,11-12,19,24H,7,10H2,1-6H3/t11-,12-,19-/m1/s1 |
| SMILES | COC1=C(OC)C(OC)=C2C(=C1)C[C@@H](C)[C@@H](C)[C@@H](O)C1=CC3=C(OCO3)C(OC)=C12 |
MNX internals
| InChI (mnx) | InChI=1/C23H28O7/c1-11-7-13-8-15(25-3)20(26-4)22(27-5)17(13)18-14(19(24)12(11)2)9-16-21(23(18)28-6)30-10-29-16/h8-9,11-12,19,24H,7,10H2,1-6H3/t11-,12-,19-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][C@@H:11]1[CH2:7][C:13]2=[CH:8][C:15]([O:25][CH3:3])=[C:20]([O:26][CH3:4])[C:22]([O:27][CH3:5])=[C:17]2[C:18]2=[C:14]([CH:9]=[C:16]3[C:21](=[C:23]2[O:28][CH3:6])[O:30][CH2:10][O:29]3)[C@H:19]([OH:24])[C@@H:12]1[CH3:2] |
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