| Properties | Image |
|---|
| MNX_ID | MNXM102737 |
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| reference | chebi:65406 |
| formula | C25H27NO4 |
| global charge | 0 |
| mol weight | 405.494 |
| InChIKey | QGIHYQPVZRSTNP-AWEZNQCLSA-N |
| InChI | InChI=1S/C25H27NO4/c1-13-10-16-8-7-9-18(28-4)23(16)25(27)21(13)24-17-11-14(2)26-15(3)22(17)19(29-5)12-20(24)30-6/h7-10,12,14,27H,11H2,1-6H3/t14-/m0/s1 |
| SMILES | COC1=CC=CC2=CC(C)=C(C3=C(OC)C=C(OC)C4=C3C[C@H](C)N=C4C)C(O)=C21 |
MNX internals
| InChI (mnx) | InChI=1/C25H27NO4/c1-13-10-16-8-7-9-18(28-4)23(16)25(27)21(13)24-17-11-14(2)26-15(3)22(17)19(29-5)12-20(24)30-6/h7-10,12,14,27H,11H2,1-6H3/t14-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][C:13]1=[C:21]([C:24]2=[C:20]([O:30][CH3:6])[CH:12]=[C:19]([O:29][CH3:5])[C:22]3=[C:17]2[CH2:11][C@H:14]([CH3:2])[N:26]=[C:15]3[CH3:3])[C:25]([OH:27])=[C:23]2[C:16](=[CH:10]1)[CH:8]=[CH:7][CH:9]=[C:18]2[O:28][CH3:4] |
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