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(Q83036661)
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English
3',4',7-Trimethoxyisoflavone
chemical compound
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default values for all languages
No label defined
No description defined
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Statements
instance of
type of chemical entity
0 references
subclass of
isoflavone
0 references
isoflavonoid
0 references
mass
312.099773612
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₈H₁₆O₅
0 references
canonical SMILES
COC1=CC2=C(C=C1)C(=O)C(=CO2)C3=CC(=C(C=C3)OC)OC
0 references
found in taxon
Araucaria angustifolia
3 references
stated in
Phenylpropanoid derivatives and biflavones at different stages of differentiation and development of Araucaria angustifolia.
stated in
Phenylpropanoid derivatives and biflavones at different stages of differentiation and development of Araucaria angustifolia.
stated in
Phenylpropanoid derivatives and biflavones at different stages of differentiation and development of Araucaria angustifolia.
Myroxylon peruiferum
4 references
stated in
Isoflavonoids from Myroxylon peruiferum
stated in
Microanalysis of a selective potent anti-Helicobacter pylori compound in a Brazilian medicinal plant, Myroxylon peruiferum and the activity of analogues
stated in
Microanalysis of a selective potent anti-Helicobacter pylori compound in a Brazilian medicinal plant, Myroxylon peruiferum and the activity of analogues
stated in
Microanalysis of a selective potent anti-Helicobacter pylori compound in a Brazilian medicinal plant, Myroxylon peruiferum and the activity of analogues
Muntingia calabura
2 references
stated in
Activity-guided isolation of the chemical constituents of Muntingia calabura using a quinone reductase induction assay.
stated in
Activity-guided isolation of the chemical constituents of Muntingia calabura using a quinone reductase induction assay.
Senna alata
1 reference
stated in
Alatinone, an anthraquinone from Cassia alata
Identifiers
InChI
InChI=1S/C18H16O5/c1-20-12-5-6-13-16(9-12)23-10-14(18(13)19)11-4-7-15(21-2)17(8-11)22-3/h4-10H,1-3H3
0 references
InChIKey
UKWLNMIPRJLYGH-UHFFFAOYSA-N
0 references
CAS Registry Number
1621-61-0
1 reference
InChIKey
UKWLNMIPRJLYGH-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
10 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=1621-61-0
PubChem CID
628528
1 reference
matched by identifier from
InChIKey
InChIKey
UKWLNMIPRJLYGH-UHFFFAOYSA-N
ChEBI ID
174979
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C18H16O5/c1-20-12-5-6-13-16(9-12)23-10-14(18(13)19)11-4-7-15(21-2)17(8-11)22-3/h4-10H,1-3H3
UniChem compound ID
137105
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID70167311
1 reference
matched by identifier from
InChIKey
InChIKey
UKWLNMIPRJLYGH-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID0089802
0 references
Human Metabolome Database ID
HMDB0030679
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
UKWLNMIPRJLYGH-UHFFFAOYSA-N
KNApSAcK ID
C00009405
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
UKWLNMIPRJLYGH-UHFFFAOYSA-N
LIPID MAPS ID
LMPK12050060
1 reference
stated in
LIPID MAPS
reference URL
http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download
retrieved
30 June 2018
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