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(Q76309382)
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English
(1R,9R,10R)-17-[2-(furan-2-yl)ethyl]-4-methoxy-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-triene
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
morphinan alkaloid
1 reference
based on heuristic
inferred from SMILES
mass
351.219829168
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₂₃H₂₉NO₂
0 references
canonical SMILES
COc1ccc2c(c1)C13CCCCC1C(C2)N(CCc1ccco1)CC3
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
COC1=CC2=C(C[C@@H]3[C@H]4[C@@]2(CCCC4)CCN3CCC5=CC=CO5)C=C1
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Identifiers
InChI
InChI=1S/C23H29NO2/c1-25-19-8-7-17-15-22-20-6-2-3-10-23(20,21(17)16-19)11-13-24(22)12-9-18-5-4-14-26-18/h4-5,7-8,14,16,20,22H,2-3,6,9-13,15H2,1H3/t20-,22+,23+/m0/s1
0 references
InChIKey
CPTGBMIVOKLNKH-MDNUFGMLSA-N
0 references
PubChem CID
5486041
1 reference
matched by identifier from
InChIKey
InChIKey
CPTGBMIVOKLNKH-MDNUFGMLSA-N
UniChem compound ID
48579415
1 reference
stated in
UniChem
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