Hmdra
(Q82893815)
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chemical compound
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English
Hmdra
chemical compound
Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
284.104858992
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₇H₁₆O₄
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
O=C1C=CC2(C=C1)C1COCC2c2cc(O)c(O)cc2C1
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
O=C1C=CC2(C=C1)C1COC[C@H]2Cc2cc(O)c(O)cc21
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C17H16O4/c18-12-1-3-17(4-2-12)11-5-10-6-15(19)16(20)7-13(10)14(17)9-21-8-11/h1-4,6-7,11,14,19-20H,5,8-9H2/t11-,14?/m1/s1
0 references
InChIKey
ZMEYLNFPIDENDY-YNODCEANSA-N
0 references
CAS Registry Number
113459-56-6
0 references
PubChem CID
3081034
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
ZMEYLNFPIDENDY-YNODCEANSA-N
UniChem compound ID
56162833
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID70921076
1 reference
matched by identifier from
InChIKey
InChIKey
ZMEYLNFPIDENDY-YNODCEANSA-N
DSSTOX compound identifier
DTXCID401349976
0 references
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