ACETYLROLANDROLIDE
Molecular Formula:
C23H28O9
InChI: InChI=1/C23H28O9/c1-12(2)21(26)31-18-8-13(3)7-16(30-15(5)25)9-23(6,28)10-19-20(18)17(22(27)32-19)11-29-14(4)24/h7,10,16,18,28H,1,8-9,11H2,2-6H3/b13-7-,19-10+/t16-,18+,23-/m0/s1
InChIKey: InChIKey=SBZYIOCHWBZFIG-FHIRRPESBP
SMILES: CC1=CC(CC(C=C2C(=C(C(=O)O2)COC(=O)C)C(C1)OC(=O)C(=C)C)(C)O)OC(=O)C
Names:
ACETYLROLANDROLIDE
NSC335663
[(2R,4Z,6R,8S,9E)-6-acetyloxy-13-(acetyloxymethyl)-8-hydroxy-4,8-dimethyl-12-oxo-11-oxabicyclo[8.3.0]trideca-4,9,13-trien-2-yl] 2-methylprop-2-enoate
Registries:
PubChem CID 5384465
PubChem ID 8141281
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