| Properties | Image |
MNX_ID | MNXM165985 |
 |
reference | sabiorkM:25330 |
formula | C16H18O6 |
global charge | 0 |
mol weight | 306.314 |
InChIKey | MWHKPYATGMFFPI-UHFFFAOYSA-N |
InChI | InChI=1S/C16H18O6/c17-8-12-13(18)14(19)15(20)16(22-12)21-11-6-5-9-3-1-2-4-10(9)7-11/h1-7,12-20H,8H2 |
SMILES | OCC1OC(OC2=CC3=CC=CC=C3C=C2)C(O)C(O)C1O |
MNX internals
InChI (mnx) | InChI=1/C16H18O6/c17-8-12-13(18)14(19)15(20)16(22-12)21-11-6-5-9-3-1-2-4-10(9)7-11/h1-7,12-20H,8H2/t12?,13?,14?,15?,16? |
 |
SMILES (mnx) | [CH:1]1=[CH:2][CH:4]=[C:10]2[CH:7]=[C:11]([O:21][CH:16]3[CH:15]([OH:20])[CH:14]([OH:19])[CH:13]([OH:18])[CH:12]([CH2:8][OH:17])[O:22]3)[CH:6]=[CH:5][C:9]2=[CH:3]1 |
|