| Properties | Image |
|---|
| MNX_ID | MNXM1371640 |
 |
| reference | metacycM:DIHYDROBIOCHANIN-A |
| formula | C16H14O5 |
| global charge | 0 |
| mol weight | 286.283 |
| InChIKey | KYMFSIXLIKXHRD-UHFFFAOYSA-N |
| InChI | InChI=1S/C16H14O5/c1-20-11-4-2-9(3-5-11)12-8-21-14-7-10(17)6-13(18)15(14)16(12)19/h2-8,16-19H,1H3 |
| SMILES | COC1=CC=C(C2=COC3=CC(O)=CC(O)=C3C2O)C=C1 |
MNX internals
| InChI (mnx) | InChI=1/C16H14O5/c1-20-11-4-2-9(3-5-11)12-8-21-14-7-10(17)6-13(18)15(14)16(12)19/h2-8,16-19H,1H3/t16? |
 |
| SMILES (mnx) | [CH3:1][O:20][C:11]1=[CH:5][CH:3]=[C:9]([C:12]2=[CH:8][O:21][C:14]3=[CH:7][C:10]([OH:17])=[CH:6][C:13]([OH:18])=[C:15]3[CH:16]2[OH:19])[CH:2]=[CH:4]1 |
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