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(Q83003435)
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English
2-Methoxy-14-methyl-1,2,5,6-tetrahydro-3H,9H-5,11b-(epiminoethano)phenanthro[2,3-d][1,3]dioxol-3-one
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
327.147058152
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
stereoisomer of
Amurinine
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₁₉H₂₁NO₄
0 references
canonical SMILES
COC1CC23CCN(C)C(Cc4cc5c(cc42)OCO5)C3=CC1=O
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CN1CC[C@]23C[C@@H](C(=O)C=C2[C@H]1CC4=CC5=C(C=C34)OCO5)OC
0 references
Identifiers
InChI
InChI=1S/C19H21NO4/c1-20-4-3-19-9-18(22-2)15(21)7-13(19)14(20)5-11-6-16-17(8-12(11)19)24-10-23-16/h6-8,14,18H,3-5,9-10H2,1-2H3/t14-,18+,19-/m1/s1
0 references
InChIKey
PPCPJTZWJZSEGN-MDASCCDHSA-N
0 references
CAS Registry Number
87220-76-6
0 references
PubChem CID
5488783
1 reference
matched by identifier from
InChIKey
InChIKey
PPCPJTZWJZSEGN-MDASCCDHSA-N
UniChem compound ID
50623450
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID701007430
1 reference
matched by identifier from
InChIKey
InChIKey
PPCPJTZWJZSEGN-MDASCCDHSA-N
DSSTOX compound identifier
DTXCID301434283
0 references
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