(Q105314284)

English

8-hydroxy-7-[(E)-3-methyl-4-[(2S)-4-methylidene-5-oxooxolan-2-yl]but-2-enoxy]chromen-2-one

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

8-hydroxy-7-{[(2E)-3-[(4-methylidene-5-oxooxolan-2-yl)methyl]but-2-en-1-yl]oxy}chromen-2-one

1 reference

based on heuristic

inferred from SMILES

8-Hydroxy-7-[3-methyl-4-(4-methylidene-5-oxooxolan-2-yl)but-2-enoxy]chromen-2-one

1 reference

based on heuristic

inferred from SMILES

mass

342.110338296 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₉H₁₈O₆

0 references

canonical SMILES

O=C1OC=2C(O)=C(OCC=C(C)CC3OC(=O)C(=C)C3)C=CC2C=C1

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isomeric SMILES

C=C1C[C@H](C/C(C)=C/COc2ccc3ccc(=O)oc3c2O)OC1=O

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found in taxon

Clausena excavata

2 references

stated in

Chemical Constituents ofClausena excavata: Isolation and Structure Elucidation of Novel Furanone-Coumarins with Inhibitory Effects for Tumor-Promotion1

stated in

Chemical constituents of Clausena excavata: isolation and structure elucidation of novel furanone-coumarins with inhibitory effects for tumor-promotion

Murraya koenigii

2 references

stated in

Chemical constituents of Murraya siamensis: three coumarins and their anti-tumor promoting effect.

stated in

Induction of apoptosis in human leukaemia HL-60 cells by furanone-coumarins from Murraya siamensis

Murraya siamensis

2 references

stated in

Chemical constituents of Murraya siamensis: three coumarins and their anti-tumor promoting effect.

stated in

Induction of apoptosis in human leukaemia HL-60 cells by furanone-coumarins from Murraya siamensis

Identifiers

InChI

InChI=1S/C19H18O6/c1-11(9-14-10-12(2)19(22)24-14)7-8-23-15-5-3-13-4-6-16(20)25-18(13)17(15)21/h3-7,14,21H,2,8-10H2,1H3/b11-7+/t14-/m0/s1

0 references

InChIKey

WWTBMZAWBGEHRW-OIOXUXFSSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

WWTBMZAWBGEHRW-OIOXUXFSSA-N

(Q105314284)

8-hydroxy-7-[(E)-3-methyl-4-[(2S)-4-methylidene-5-oxooxolan-2-yl]but-2-enoxy]chromen-2-one

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