(Q105158134)

English

5,7-dihydroxy-4-[(1R)-1-hydroxypropyl]-8-[(2R)-2-methylbutanoyl]-6-(3-methylbut-2-enyl)chromen-2-one

chemical compound

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instance of

type of chemical entity

0 references

1 reference

1 reference

388.188588616 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

5,7-dihydroxy-4-[(1S)-1-hydroxypropyl]-8-[(2R)-2-methylbutanoyl]-6-(3-methylbut-2-enyl)chromen-2-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₂H₂₈O₆

0 references

canonical SMILES

O=C1OC=2C(=C(O)C(=C(O)C2C(=C1)C(O)CC)CC=C(C)C)C(=O)C(C)CC

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isomeric SMILES

CC[C@@H](C)C(=O)c1c(O)c(CC=C(C)C)c(O)c2c([C@H](O)CC)cc(=O)oc12

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found in taxon

Mesua assamica

1 reference

stated in

An alkylated coumarin from Kayea assamica

Mesua ferrea

1 reference

stated in

4-Alkyl- and 4-phenylcoumarins from Mesua ferrea as promising multidrug resistant antibacterials

Identifiers

InChI

InChI=1S/C22H28O6/c1-6-12(5)19(25)18-21(27)13(9-8-11(3)4)20(26)17-14(15(23)7-2)10-16(24)28-22(17)18/h8,10,12,15,23,26-27H,6-7,9H2,1-5H3/t12-,15-/m1/s1

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InChIKey

LVYGPLHUPURZDF-IUODEOHRSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

LVYGPLHUPURZDF-IUODEOHRSA-N

(Q105158134)

5,7-dihydroxy-4-[(1R)-1-hydroxypropyl]-8-[(2R)-2-methylbutanoyl]-6-(3-methylbut-2-enyl)chromen-2-one

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