(Q105235411)

English

(2S)-2-Isopropenyl-4-(3-methylbutyryl)-5-hydroxy-6-phenyl-1,2-dihydro-3,9-dioxa-8H-benzo[e]indene-8-one

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

4-phenylcoumarin flavonoid

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mass

404.162373868 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₅H₂₄O₅

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canonical SMILES

O=C1OC2=C(C(O)=C(C(=O)CC(C)C)C=3OC(C(=C)C)CC23)C(=C1)C=4C=CC=CC4

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isomeric SMILES

C=C(C)[C@@H]1Cc2c(c(C(=O)CC(C)C)c(O)c3c(-c4ccccc4)cc(=O)oc23)O1

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found in taxon

Mesua ferrea

1 reference

stated in

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

Calophyllum dispar

1 reference

stated in

Novel cytotoxic 4-phenylfuranocoumarins from Calophyllum dispar

Identifiers

InChI

InChI=1S/C25H24O5/c1-13(2)10-18(26)22-23(28)21-16(15-8-6-5-7-9-15)12-20(27)30-24(21)17-11-19(14(3)4)29-25(17)22/h5-9,12-13,19,28H,3,10-11H2,1-2,4H3/t19-/m0/s1

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InChIKey

RFHMEYQQYUJGMP-IBGZPJMESA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

RFHMEYQQYUJGMP-IBGZPJMESA-N

1 reference

(Q105235411)

(2S)-2-Isopropenyl-4-(3-methylbutyryl)-5-hydroxy-6-phenyl-1,2-dihydro-3,9-dioxa-8H-benzo[e]indene-8-one

Statements

Identifiers

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