(Q104987043)

English

3-Butylidene-6,7-dihydroxy-4,5,6,7-tetrahydro-2-benzofuran-1-one

group of stereoisomers with the chemical formula C₁₂H₁₆O₄

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Statements

instance of

group of stereoisomers

0 references

subclass of

chemical compound

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mass

224.104858992 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₂H₁₆O₄

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canonical SMILES

O=C1OC(=CCCC)C2=C1C(O)C(O)CC2

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found in taxon

Angelica acutiloba

1 reference

stated in

Identification and quantification of 13 components in Angelica sinensis (Danggui) by gas chromatography–mass spectrometry coupled with pressurized liquid extraction

Angelica gigas

1 reference

stated in

Identification and quantification of 13 components in Angelica sinensis (Danggui) by gas chromatography–mass spectrometry coupled with pressurized liquid extraction

Angelica sinensis

2 references

stated in

Identification and quantification of 13 components in Angelica sinensis (Danggui) by gas chromatography–mass spectrometry coupled with pressurized liquid extraction

stated in

GABAergic phthalide dimers fromAngelica sinensis (Oliv.) Diels

Identifiers

InChI

InChI=1S/C12H16O4/c1-2-3-4-9-7-5-6-8(13)11(14)10(7)12(15)16-9/h4,8,11,13-14H,2-3,5-6H2,1H3

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InChIKey

DQNGMIQSXNGHOA-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

DQNGMIQSXNGHOA-UHFFFAOYSA-N

1 reference

Human Metabolome Database ID

HMDB0258236

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

DQNGMIQSXNGHOA-UHFFFAOYSA-N

Probes And Drugs ID

PD087596

0 references

(Q104987043)

3-Butylidene-6,7-dihydroxy-4,5,6,7-tetrahydro-2-benzofuran-1-one

Statements

Identifiers

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