Simalikalactone D
Molecular Formula:
C25H34O9
InChI: InChI=1/C25H34O9/c1-6-10(2)21(30)34-16-18-24(5)20(29)15(27)17-23(4)12(11(3)7-13(26)19(23)28)8-14(33-22(16)31)25(17,18)9-32-24/h7,10,12,14-20,27-29H,6,8-9H2,1-5H3/t10-,12+,14-,15-,16-,17-,18+,19-,20+,23+,24-,25u/m1/s1
InChIKey: InChIKey=OKIKYYZNNZCZRX-WFECKCGTBD
SMILES: CCC(C)C(=O)OC1C2C3(C(C(C4C2(CO3)C(CC5C4(C(C(=O)C=C5C)O)C)OC1=O)O)O)C
Names:
Picras-3-ene-2,16-dione, 13,20-epoxy-1,11,12-trihydroxy-15-(2-methyl-1-oxobutoxy)-, (11beta)-
Simalikalactone D
35321-80-3
Registries:
PubChem CID 65397
PubChem ID 207383
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