| Properties | Image |
| MNX_ID | MNXM1131075 |
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| reference | lipidmapsM:LMPK12140701 |
| formula | C18H18O5 |
| global charge | 0 |
| mol weight | 314.337 |
| InChIKey | QMFKCIGTCHYXMA-WBVHZDCISA-N |
| InChI | InChI=1S/C18H18O5/c1-10-13(21-2)9-12-14(19)15(20)17(11-7-5-4-6-8-11)23-18(12)16(10)22-3/h4-9,15,17,20H,1-3H3/t15-,17+/m1/s1 |
| SMILES | COC1=CC2=C(O[C@@H](C3=CC=CC=C3)[C@H](O)C2=O)C(OC)=C1C |
MNX internals
| InChI (mnx) | InChI=1/C18H18O5/c1-10-13(21-2)9-12-14(19)15(20)17(11-7-5-4-6-8-11)23-18(12)16(10)22-3/h4-9,15,17,20H,1-3H3/t15-,17+/m1/s1 |
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| SMILES (mnx) | [CH3:1][C:10]1=[C:13]([O:21][CH3:2])[CH:9]=[C:12]2[C:14](=[O:19])[C@@H:15]([OH:20])[C@H:17]([C:11]3=[CH:7][CH:5]=[CH:4][CH:6]=[CH:8]3)[O:23][C:18]2=[C:16]1[O:22][CH3:3] |
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