| Properties | Image |
|---|
| MNX_ID | MNXM12083 |
 |
| reference | chebi:81890 |
| formula | C25H24O8 |
| global charge | 0 |
| mol weight | 452.459 |
| InChIKey | KQMFSFYTGVMRPL-PJLSVRSMSA-N |
| InChI | InChI=1S/C25H24O8/c1-10-6-12-8-15(27)21-22(19(12)14(26)7-10)24(30)13-4-3-5-17(20(13)25(21)31)33-18-9-16(28)23(29)11(2)32-18/h3-7,11,15-16,18,23,26-29H,8-9H2,1-2H3/t11-,15-,16-,18+,23-/m1/s1 |
| SMILES | CC1=CC2=C(C(O)=C1)C1=C(C(=O)C3=C(O[C@H]4C[C@@H](O)[C@H](O)[C@@H](C)O4)C=CC=C3C1=O)[C@H](O)C2 |
MNX internals
| InChI (mnx) | InChI=1/C25H24O8/c1-10-6-12-8-15(27)21-22(19(12)14(26)7-10)24(30)13-4-3-5-17(20(13)25(21)31)33-18-9-16(28)23(29)11(2)32-18/h3-7,11,15-16,18,23,26-29H,8-9H2,1-2H3/t11-,15-,16-,18+,23-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][C:10]1=[CH:6][C:12]2=[C:19]([C:14]([OH:26])=[CH:7]1)[C:22]1=[C:21]([C@H:15]([OH:27])[CH2:8]2)[C:25](=[O:31])[C:20]2=[C:13]([CH:4]=[CH:3][CH:5]=[C:17]2[O:33][C@H:18]2[CH2:9][C@@H:16]([OH:28])[C@H:23]([OH:29])[C@@H:11]([CH3:2])[O:32]2)[C:24]1=[O:30] |
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