(Q105270176)

English

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

group of stereoisomers with the chemical formula C₂₀H₁₇NO₈

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Statements

group of stereoisomers

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biogenic anthraquinones

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biogenic anthraquinones

399.09541650399984 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₀H₁₇NO₈

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canonical SMILES

CC(C)C(NC(=O)c1cc(O)c2c(c1)C(=O)c1cc(O)cc(O)c1C2=O)C(=O)O

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Identifiers

InChI=1S/C20H17NO8/c1-7(2)16(20(28)29)21-19(27)8-3-10-14(12(23)4-8)18(26)15-11(17(10)25)5-9(22)6-13(15)24/h3-7,16,22-24H,1-2H3,(H,21,27)(H,28,29)

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UCVOTAWBWPEXMD-UHFFFAOYSA-N

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2 references

based on heuristic

inferred from InChIKey

matched by identifier from

UCVOTAWBWPEXMD-UHFFFAOYSA-N

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