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(Q105129890)
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English
1,5-Dihydroxy-2-methoxy-6-methylanthraquinone
chemical compound
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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
biogenic anthraquinones
0 references
mass
284.068473484
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₆H₁₂O₅
0 references
canonical SMILES
O=C1C2=CC=C(C(O)=C2C(=O)C3=CC=C(OC)C(O)=C13)C
0 references
found in taxon
Morinda citrifolia
1 reference
stated in
A new anthraquinone from Morinda citrifolia roots
Identifiers
InChI
InChI=1S/C16H12O5/c1-7-3-4-8-11(13(7)17)14(18)9-5-6-10(21-2)16(20)12(9)15(8)19/h3-6,17,20H,1-2H3
0 references
InChIKey
JJTIQZJKQCQNJK-UHFFFAOYSA-N
0 references
CAS Registry Number
63965-45-7
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
13412795
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
JJTIQZJKQCQNJK-UHFFFAOYSA-N
ChEBI ID
174711
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C16H12O5/c1-7-3-4-8-11(13(7)17)14(18)9-5-6-10(21-2)16(20)12(9)15(8)19/h3-6,17,20H,1-2H3
UniChem compound ID
31995219
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID401213876
1 reference
matched by identifier from
InChIKey
InChIKey
JJTIQZJKQCQNJK-UHFFFAOYSA-N
Human Metabolome Database ID
HMDB0039578
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
JJTIQZJKQCQNJK-UHFFFAOYSA-N
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