(Q105236399)

English

Methyl 3-methyl-2-[(4,5,7-trihydroxy-9,10-dioxoanthracene-2-carbonyl)amino]pentanoate

group of stereoisomers with the chemical formula C₂₂H₂₁NO₈

In more languages

Statements

group of stereoisomers

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biogenic anthraquinones

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biogenic anthraquinones

427.12671663199984 dalton

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based on heuristic

inferred from InChI

chemical formula

C₂₂H₂₁NO₈

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canonical SMILES

CCC(C)C(NC(=O)c1cc(O)c2c(c1)C(=O)c1cc(O)cc(O)c1C2=O)C(=O)OC

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Identifiers

InChI=1S/C22H21NO8/c1-4-9(2)18(22(30)31-3)23-21(29)10-5-12-16(14(25)6-10)20(28)17-13(19(12)27)7-11(24)8-15(17)26/h5-9,18,24-26H,4H2,1-3H3,(H,23,29)

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RHIKPDQWISFYIG-UHFFFAOYSA-N

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2 references

based on heuristic

inferred from InChIKey

matched by identifier from

RHIKPDQWISFYIG-UHFFFAOYSA-N

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