compactin
Molecular Formula:
C23H34O5
InChI: InChI=1/C23H34O5/c1-4-14(2)23(26)28-20-7-5-6-16-9-8-15(3)19(22(16)20)11-10-18-12-17(24)13-21(25)27-18/h6,8-9,14-15,17-20,22,24H,4-5,7,10-13H2,1-3H3/t14-,15-,17+,18?,19u,20-,22-/m0/s1
InChIKey: InChIKey=AJLFOPYRIVGYMJ-SBQDAUBJBJ
SMILES: CCC(C)C(=O)OC1CCC=C2C1C(C(C=C2)C)CCC3CC(CC(=O)O3)O
Names:
compactin
[(1S,7R,8aS)-8-[2-[(4R)-4-hydroxy-6-oxo-oxan-2-yl]ethyl]-7-methyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] (2S)-2-methylbutanoate
Registries:
PubChem CID 5702286
PubChem ID 8150106
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