| Properties | Image |
MNX_ID | MNXM161388 |
 |
reference | chebi:86951 |
formula | C26H30O10 |
global charge | 0 |
mol weight | 502.516 |
InChIKey | FEDJEJQAGQWOHV-UHFFFAOYSA-N |
InChI | InChI=1S/C26H30O10/c1-13(27)35-25-19(29-3)7-15(8-20(25)30-4)23-17-11-34-24(18(17)12-33-23)16-9-21(31-5)26(36-14(2)28)22(10-16)32-6/h7-10,17-18,23-24H,11-12H2,1-6H3 |
SMILES | COC1=CC(C2OCC3C(C4=CC(OC)=C(OC(C)=O)C(OC)=C4)OCC23)=CC(OC)=C1OC(C)=O |
MNX internals
InChI (mnx) | InChI=1/C26H30O10/c1-13(27)35-25-19(29-3)7-15(8-20(25)30-4)23-17-11-34-24(18(17)12-33-23)16-9-21(31-5)26(36-14(2)28)22(10-16)32-6/h7-10,17-18,23-24H,11-12H2,1-6H3/t17?,18?,23?,24? |
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SMILES (mnx) | [CH3:1][C:13](=[O:27])[O:35][C:25]1=[C:19]([O:29][CH3:3])[CH:7]=[C:15]([CH:23]2[CH:17]3[CH2:11][O:34][CH:24]([C:16]4=[CH:9][C:21]([O:31][CH3:5])=[C:26]([O:36][C:14]([CH3:2])=[O:28])[C:22]([O:32][CH3:6])=[CH:10]4)[CH:18]3[CH2:12][O:33]2)[CH:8]=[C:20]1[O:30][CH3:4] |
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