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(Q77371392)
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English
3',5,7-trihydroxy-4',8-dimethoxyisoflavone
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
isoflavone
0 references
isoflavonoid
0 references
mass
330.073952788
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₇H₁₄O₇
0 references
canonical SMILES
COC1=C(C=C(C=C1)C2=COC3=C(C2=O)C(=CC(=C3OC)O)O)O
0 references
found in taxon
Streptomyces roseolus
1 reference
stated in
New isoflavones, inhibiting catechol-O-methyltransferase, produced by Streptomyces
Monopteryx inpae
1 reference
stated in
Isoflavone evolution in Monopteryx
Iris domestica
1 reference
stated in
An isoflavone noririsflorentin from Belamcanda chinensis
Identifiers
InChI
InChI=1S/C17H14O7/c1-22-13-4-3-8(5-10(13)18)9-7-24-17-14(15(9)21)11(19)6-12(20)16(17)23-2/h3-7,18-20H,1-2H3
0 references
InChIKey
GWHLXSNSYSNMEV-UHFFFAOYSA-N
2 references
stated in
PubChem
PubChem CID
5745466
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
5745466
language of work or name
English
CAS Registry Number
56419-18-2
0 references
PubChem CID
5745466
2 references
stated in
PubChem
PubChem CID
5745466
language of work or name
English
matched by identifier from
InChIKey
InChIKey
GWHLXSNSYSNMEV-UHFFFAOYSA-N
ChEBI ID
202445
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C17H14O7/c1-22-13-4-3-8(5-10(13)18)9-7-24-17-14(15(9)21)11(19)6-12(20)16(17)23-2/h3-7,18-20H,1-2H3
UniChem compound ID
26587088
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID20204982
1 reference
matched by identifier from
InChIKey
InChIKey
GWHLXSNSYSNMEV-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID50127473
0 references
KNApSAcK ID
C00009475
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
GWHLXSNSYSNMEV-UHFFFAOYSA-N
Natural Product Atlas ID
NPA005242
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
GWHLXSNSYSNMEV-UHFFFAOYSA-N
LIPID MAPS ID
LMPK12050434
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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