(Q105255736)

English

Unii-H73C5W8fne

group of stereoisomers with the chemical formula C₂₂H₂₅NO₈

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Statements

group of stereoisomers

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1 reference

431.15801676 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₂₂H₂₅NO₈

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canonical SMILES

CCC=CC(O)C(O)C1=C(C)C(=O)C2(O1)C(=O)NC(OC)(C(=O)c1ccccc1)C2O

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isomeric SMILES

CC/C=C/[C@H](O)[C@H](O)C1=C(C)C(=O)C2(O1)C(=O)N[C@@](OC)(C(=O)c1ccccc1)[C@@H]2O

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Pseurotin, a new metabolite of Pseudeurotium ovalis Stolk having an unusual hetero-spirocyclic system

Identifiers

InChI=1S/C22H25NO8/c1-4-5-11-14(24)15(25)16-12(2)17(26)21(31-16)19(28)22(30-3,23-20(21)29)18(27)13-9-7-6-8-10-13/h5-11,14-15,19,24-25,28H,4H2,1-3H3,(H,23,29)/b11-5+/t14-,15-,19+,21?,22+/m0/s1

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SLYDIPAXCVVRNY-FGTQFNLASA-N

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17 September 2022

based on heuristic

inferred from InChIKey

UniChem compound ID

1 reference

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