(Q105216488)

English

[(1S)-1-(5,8-dihydroxy-1,4-dioxonaphthalen-2-yl)-4-hydroxy-4-methylpentyl] acetate

chemical compound

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Statements

type of chemical entity

0 references

1 reference

based on heuristic

inferred from SMILES

348.12090298 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₈H₂₀O₇

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canonical SMILES

O=C1C=C(C(=O)C=2C(O)=CC=C(O)C12)C(OC(=O)C)CCC(O)(C)C

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isomeric SMILES

CC(=O)O[C@@H](CCC(C)(C)O)C1=CC(=O)c2c(O)ccc(O)c2C1=O

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Arnebia speciosa

1 reference

Naphthaquinones of Arnebia nobilis

Identifiers

InChI=1S/C18H20O7/c1-9(19)25-14(6-7-18(2,3)24)10-8-13(22)15-11(20)4-5-12(21)16(15)17(10)23/h4-5,8,14,20-21,24H,6-7H2,1-3H3/t14-/m0/s1

0 references

PXZQQYIKQDQBEP-AWEZNQCLSA-N

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1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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