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l-Centrolobine
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
d-Centrolobine
1 reference
based on heuristic
inferred from InChIKey
mass
312.17254462799997
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
Centrolobine
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(+)-Centrolobine
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₂₀H₂₄O₃
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
COc1ccc(C2CCCC(CCc3ccc(O)cc3)O2)cc1
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
COc1ccc(C2CCC[C@H](CCc3ccc(O)cc3)O2)cc1
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C20H24O3/c1-22-18-13-8-16(9-14-18)20-4-2-3-19(23-20)12-7-15-5-10-17(21)11-6-15/h5-6,8-11,13-14,19-21H,2-4,7,12H2,1H3/t19-,20?/m1/s1
0 references
InChIKey
VKLGDLFSGNHXAV-FIWHBWSRSA-N
0 references
CAS Registry Number
30358-99-7
0 references
PubChem CID
336371
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
VKLGDLFSGNHXAV-FIWHBWSRSA-N
UniChem compound ID
55153515
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID10319771
1 reference
matched by identifier from
InChIKey
InChIKey
VKLGDLFSGNHXAV-FIWHBWSRSA-N
DSSTOX compound identifier
DTXCID70270894
0 references
NSC number
350139
0 references
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