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(Q105176341)
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English
7-Hydroxy-2',3',4'-trimethoxyisoflavan
group of stereoisomers with the chemical formula C₁₈H₂₀O₅
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Statements
instance of
group of stereoisomers
0 references
subclass of
isoflavane
1 reference
inferred from
isoflavane
mass
316.13107374
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₈H₂₀O₅
0 references
canonical SMILES
OC1=CC=C2C(OCC(C3=CC=C(OC)C(OC)=C3OC)C2)=C1
0 references
found in taxon
Astragalus pycnocephalus
2 references
stated in
Antimicrobial isoflavans from Astragalus species
stated in
Cycloartane triterpene glycosides from Astragalus alexandrinus
Identifiers
InChI
InChI=1S/C18H20O5/c1-20-15-7-6-14(17(21-2)18(15)22-3)12-8-11-4-5-13(19)9-16(11)23-10-12/h4-7,9,12,19H,8,10H2,1-3H3
0 references
InChIKey
NAIULWLSYSLHJW-UHFFFAOYSA-N
0 references
PubChem CID
54100766
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
NAIULWLSYSLHJW-UHFFFAOYSA-N
ChEBI ID
175069
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C18H20O5/c1-20-15-7-6-14(17(21-2)18(15)22-3)12-8-11-4-5-13(19)9-16(11)23-10-12/h4-7,9,12,19H,8,10H2,1-3H3
UniChem compound ID
31673528
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0039510
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
NAIULWLSYSLHJW-UHFFFAOYSA-N
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