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(Q76423983)
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English
Isoauroside
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
flavanone
1 reference
based on heuristic
inferred from SMILES
mass
302.07903816799995
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
stereoisomer of
(2S,3R)-3,5-dihydroxy-2-(4-hydroxyphenyl)-7-methoxy-2,3-dihydrochromen-4-one
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
3,4',5-Trihydroxy-7-methoxyflavanone
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₆H₁₄O₆
0 references
canonical SMILES
COc1cc(O)c2c(c1)OC(c1ccc(O)cc1)C(O)C2=O
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
COC1=CC(=C2C(=C1)O[C@@H]([C@@H](C2=O)O)C3=CC=C(C=C3)O)O
0 references
Identifiers
InChI
InChI=1S/C16H14O6/c1-21-10-6-11(18)13-12(7-10)22-16(15(20)14(13)19)8-2-4-9(17)5-3-8/h2-7,15-18,20H,1H3/t15-,16-/m1/s1
0 references
InChIKey
LZLGHWHSUZVUFZ-HZPDHXFCSA-N
0 references
CAS Registry Number
35815-06-6
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
14794883
1 reference
matched by identifier from
InChIKey
InChIKey
LZLGHWHSUZVUFZ-HZPDHXFCSA-N
UniChem compound ID
99885260
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID101127995
1 reference
matched by identifier from
InChIKey
InChIKey
LZLGHWHSUZVUFZ-HZPDHXFCSA-N
Human Metabolome Database ID
HMDB0037507
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
LZLGHWHSUZVUFZ-HZPDHXFCSA-N
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