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(Q82733693)
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English
(3S)-3,5,7-Trihydroxy-9-methyl-3,4-dihydroanthracen-1(2H)-one
chemical compound
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Statements
instance of
type of chemical entity
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subclass of
3,5,7-trihydroxy-9-methyl-3,4-dihydro-2H-anthracen-1-one
1 reference
based on heuristic
inferred from SMILES
mass
258.089208928
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₅H₁₄O₄
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canonical SMILES
O=C1C=2C(=CC=3C(O)=CC(O)=CC3C2C)CC(O)C1
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isomeric SMILES
CC1=C2C(=CC3=C1C=C(C=C3O)O)C[C@@H](CC2=O)O
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found in taxon
Aloe barbadensis
1 reference
stated in
Anthrones from Aloe barbadensis
Aloe vera
1 reference
stated in
Anthrones from Aloe barbadensis
Identifiers
InChI
InChI=1S/C15H14O4/c1-7-11-4-10(17)5-13(18)12(11)3-8-2-9(16)6-14(19)15(7)8/h3-5,9,16-18H,2,6H2,1H3/t9-/m0/s1
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InChIKey
ZKFBXHXSNWPOEE-VIFPVBQESA-N
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CAS Registry Number
194145-93-2
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PubChem CID
71347130
1 reference
matched by identifier from
InChIKey
InChIKey
ZKFBXHXSNWPOEE-VIFPVBQESA-N
UniChem compound ID
56155770
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID90773079
1 reference
matched by identifier from
InChIKey
InChIKey
ZKFBXHXSNWPOEE-VIFPVBQESA-N
DSSTOX compound identifier
DTXCID40723822
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