ISOCOLUMBIN
Molecular Formula:
C20H22O6
InChI: InChI=1/C20H22O6/c1-18-9-14(11-5-8-24-10-11)25-16(21)12(18)3-6-19(2)15(18)13-4-7-20(19,23)17(22)26-13/h4-5,7-8,10,12-15,23H,3,6,9H2,1-2H3
InChIKey: InChIKey=AALLCALQGXXWNA-UHFFFAOYAD
SMILES: CC12CCC3C(=O)OC(CC3(C1C4C=CC2(C(=O)O4)O)C)C5=COC=C5
Names:
C.A.S. 471,545
ISOCOLUMBIN
NSC16037
Registries:
PubChem CID 226036
PubChem ID 79737
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