| Properties | Image |
MNX_ID | MNXM26017 |
 |
reference | lipidmapsM:LMPK12112745 |
formula | C23H24O7 |
global charge | 0 |
mol weight | 412.438 |
InChIKey | PXSHTLGJABJXLY-UHFFFAOYSA-N |
InChI | InChI=1S/C23H24O7/c1-12(2)6-8-14-17(27-3)11-16(25)19-20(26)23(29-5)21(30-22(14)19)13-7-9-15(24)18(10-13)28-4/h6-7,9-11,24-25H,8H2,1-5H3 |
SMILES | COC1=C(O)C=CC(C2=C(OC)C(=O)C3=C(O2)C(CC=C(C)C)=C(OC)C=C3O)=C1 |
MNX internals
InChI (mnx) | InChI=1/C23H24O7/c1-12(2)6-8-14-17(27-3)11-16(25)19-20(26)23(29-5)21(30-22(14)19)13-7-9-15(24)18(10-13)28-4/h6-7,9-11,24-25H,8H2,1-5H3 |
 |
SMILES (mnx) | [CH3:1][C:12]([CH3:2])=[CH:6][CH2:8][C:14]1=[C:17]([O:27][CH3:3])[CH:11]=[C:16]([OH:25])[C:19]2=[C:22]1[O:30][C:21]([C:13]1=[CH:10][C:18]([O:28][CH3:4])=[C:15]([OH:24])[CH:9]=[CH:7]1)=[C:23]([O:29][CH3:5])[C:20]2=[O:26] |
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