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(Q104945485)
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artonin U
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
8C-substituted flavone
1 reference
based on heuristic
inferred from SMILES
mass
352.13107374
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₂₀O₅
0 references
canonical SMILES
O=C1C=C(OC=2C1=C(O)C=C(OC)C2CC=C(C)C)C=3C=CC(O)=CC3
0 references
found in taxon
Artocarpus chama
2 references
stated in
New isoprenylated flavones, artochamins A--E, and cytotoxic principles from Artocarpus chama
stated in
Artonins Q, R, S, T, and U, Five New Isoprenylated Phenoles from the Bark of Artocarpus heterophyllus Lamk
Artocarpus chaplasha
2 references
stated in
New isoprenylated flavones, artochamins A--E, and cytotoxic principles from Artocarpus chama
stated in
Artonins Q, R, S, T, and U, Five New Isoprenylated Phenoles from the Bark of Artocarpus heterophyllus Lamk
Artocarpus heterophyllus
2 references
stated in
Artonins Q, R, S, T, and U, Five New Isoprenylated Phenoles from the Bark of Artocarpus heterophyllus Lamk
stated in
New isoprenylated flavones, artochamins A--E, and cytotoxic principles from Artocarpus chama
Artocarpus integer
1 reference
stated in
Artonins Q, R, S, T, and U, Five New Isoprenylated Phenoles from the Bark of Artocarpus heterophyllus Lamk
Identifiers
InChI
InChI=1S/C21H20O5/c1-12(2)4-9-15-19(25-3)11-17(24)20-16(23)10-18(26-21(15)20)13-5-7-14(22)8-6-13/h4-8,10-11,22,24H,9H2,1-3H3
0 references
InChIKey
BSZYNZDGUZYMDL-UHFFFAOYSA-N
0 references
CAS Registry Number
123549-17-7
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
44258358
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
BSZYNZDGUZYMDL-UHFFFAOYSA-N
ChEBI ID
175517
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C21H20O5/c1-12(2)4-9-15-19(25-3)11-17(24)20-16(23)10-18(26-21(15)20)13-5-7-14(22)8-6-13/h4-8,10-11,22,24H,9H2,1-3H3
UniChem compound ID
31998434
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID201124932
1 reference
matched by identifier from
InChIKey
InChIKey
BSZYNZDGUZYMDL-UHFFFAOYSA-N
Human Metabolome Database ID
HMDB0041113
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
BSZYNZDGUZYMDL-UHFFFAOYSA-N
KNApSAcK ID
C00013410
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
BSZYNZDGUZYMDL-UHFFFAOYSA-N
LIPID MAPS ID
LMPK12111015
1 reference
InChIKey
BSZYNZDGUZYMDL-UHFFFAOYSA-N
stated in
LIPID MAPS
retrieved
17 April 2021
reference URL
http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download
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