(Q105005935)

English

[(S)-[(1R,5S,6R)-5-acetyloxy-2-formyl-1,6-dimethylcyclohex-2-en-1-yl]-[(2S)-2-hydroxy-4-methyl-5-oxo-2H-furan-3-yl]methyl] 2-methylpropanoate

chemical compound

In more languages

Statements

type of chemical entity

0 references

[5-(acetyloxy)-2-formyl-1,6-dimethylcyclohex-2-en-1-yl](2-hydroxy-4-methyl-5-oxo-2H-furan-3-yl)methyl 2-methylpropanoate

1 reference

based on heuristic

inferred from SMILES

408.178417856 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₁H₂₈O₈

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canonical SMILES

O=CC1=CCC(OC(=O)C)C(C)C1(C)C(OC(=O)C(C)C)C2=C(C(=O)OC2O)C

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isomeric SMILES

CC(=O)O[C@H]1CC=C(C=O)[C@](C)([C@H](OC(=O)C(C)C)C2=C(C)C(=O)O[C@@H]2O)[C@H]1C

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Culcitium albifolium

1 reference

Highly oxygenated furoeremophilane derivatives from Senecio zoellneri

Identifiers

InChI=1S/C21H28O8/c1-10(2)18(24)28-17(16-11(3)19(25)29-20(16)26)21(6)12(4)15(27-13(5)23)8-7-14(21)9-22/h7,9-10,12,15,17,20,26H,8H2,1-6H3/t12-,15-,17+,20-,21+/m0/s1

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GBLJRCNXXBNAET-CCEXQWFXSA-N

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1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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