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(Q72483360)
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English
8-Hydroxybergapten
chemical compound
9-Hydroxy-4-methoxypsoralen
9-Hydroxy-4-methoxy-7H-furo[3,2-g][1]benzopyran-7-one
In more languages
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No label defined
No description defined
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Statements
instance of
type of chemical entity
0 references
subclass of
furanocoumarin
0 references
mass
232.037173356
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₂H₈O₅
0 references
canonical SMILES
COC1=C2C=COC2=C(C3=C1C=CC(=O)O3)O
0 references
found in taxon
Angelica dahurica
4 references
stated in
Estrogenic activity of furanocoumarins isolated from Angelica dahurica
stated in
Antioxidative activity of furanocoumarins isolated from Angelicae dahuricae
stated in
Tyrosinase-inhibitory furanocoumarin from Angelica dahurica.
stated in
Furocoumarin derivatives from radix Angelicae dahuricae and their effects on RXRα transcriptional regulation.
Ammi majus
1 reference
stated in
Coumarins and coumarin glucosides from the fruits of Ammi majus
White sapote
1 reference
stated in
Citrus bitter principles. IX. Extractives of Casimiroa edulis. Structure of zapoterin
Toddalia asiatica
3 references
stated in
Chemical Constituents from the Root Bark of FormosanZanthoxylum Ailanthoides
stated in
Toddalidimerine, a dimeric benzophenanthridine alkaloid from Toddalia asiatica
stated in
Toddanol and toddanone, two coumarins from Toddalia asiatica
Angelica japonica
1 reference
stated in
On the Constituents of the Roots of Angelica japonica A. GRAY. (3)
Leionema nudum
1 reference
stated in
The constituents of phebalium nudum hook-I
Zanthoxylum asiaticum
3 references
stated in
Chemical Constituents from the Root Bark of FormosanZanthoxylum Ailanthoides
stated in
Toddalidimerine, a dimeric benzophenanthridine alkaloid from Toddalia asiatica
stated in
Toddanol and toddanone, two coumarins from Toddalia asiatica
Identifiers
InChI
InChI=1S/C12H8O5/c1-15-10-6-2-3-8(13)17-12(6)9(14)11-7(10)4-5-16-11/h2-5,14H,1H3
0 references
InChIKey
MVJHUMZXIJPVHV-UHFFFAOYSA-N
0 references
CAS Registry Number
1603-47-0
1 reference
InChIKey
MVJHUMZXIJPVHV-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
8 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=1603-47-0
PubChem CID
3083726
1 reference
matched by identifier from
InChIKey
InChIKey
MVJHUMZXIJPVHV-UHFFFAOYSA-N
ChEBI ID
174187
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C12H8O5/c1-15-10-6-2-3-8(13)17-12(6)9(14)11-7(10)4-5-16-11/h2-5,14H,1H3
UniChem compound ID
27224796
1 reference
stated in
UniChem
NMRShiftDB structure ID
20182579
1 reference
matched by identifier from
InChIKey
InChIKey
MVJHUMZXIJPVHV-UHFFFAOYSA-N
DSSTox substance ID
DTXSID20166854
1 reference
matched by identifier from
InChIKey
InChIKey
MVJHUMZXIJPVHV-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID6089345
0 references
Human Metabolome Database ID
HMDB0036628
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
MVJHUMZXIJPVHV-UHFFFAOYSA-N
UNII
KBZ9E8KHG6
1 reference
matched by identifier from
InChIKey
InChIKey
MVJHUMZXIJPVHV-UHFFFAOYSA-N
Probes And Drugs ID
PD158111
0 references
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