| Properties | Image |
|---|
| MNX_ID | MNXM102233 |
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| reference | chebi:66558 |
| formula | C25H26O6 |
| global charge | 0 |
| mol weight | 422.477 |
| InChIKey | RLJJIYPLHFCLRD-UHFFFAOYSA-N |
| InChI | InChI=1S/C25H26O6/c1-13(2)5-6-16(14(3)4)11-18-19(27)12-20(28)21-22(29)23(30)24(31-25(18)21)15-7-9-17(26)10-8-15/h5,7-10,12,16,26-28,30H,3,6,11H2,1-2,4H3 |
| SMILES | C=C(C)C(CC=C(C)C)CC1=C(O)C=C(O)C2=C1OC(C1=CC=C(O)C=C1)=C(O)C2=O |
MNX internals
| InChI (mnx) | InChI=1/C25H26O6/c1-13(2)5-6-16(14(3)4)11-18-19(27)12-20(28)21-22(29)23(30)24(31-25(18)21)15-7-9-17(26)10-8-15/h5,7-10,12,16,26-28,30H,3,6,11H2,1-2,4H3/t16? |
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| SMILES (mnx) | [CH3:1][C:13]([CH3:2])=[CH:5][CH2:6][CH:16]([CH2:11][C:18]1=[C:25]2[C:21](=[C:20]([OH:28])[CH:12]=[C:19]1[OH:27])[C:22](=[O:29])[C:23]([OH:30])=[C:24]([C:15]1=[CH:8][CH:10]=[C:17]([OH:26])[CH:9]=[CH:7]1)[O:31]2)[C:14](=[CH2:3])[CH3:4] |
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