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(Q82951561)
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English
13-Ethyl-9-methoxy-1a,4,5,10,11,12,13,13a-octahydro-2h-3,13-methanooxireno[9,10]azacycloundecino[5,4-b]indole
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
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mass
326.199428072
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₂₆N₂O₂
0 references
canonical SMILES
O(C1=CC=CC2=C1NC3=C2CCN4CC5OC5C(C4)(CC)CC3)C
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found in taxon
Tabernaemontana cerifera
1 reference
stated in
Tertiary indole alkaloids from leaves of Tabernaemontana dichotoma
Tabernaemontana bovina
1 reference
stated in
Tertiary indole alkaloids from leaves of Tabernaemontana dichotoma
Identifiers
InChI
InChI=1S/C20H26N2O2/c1-3-20-9-7-15-13(8-10-22(12-20)11-17-19(20)24-17)14-5-4-6-16(23-2)18(14)21-15/h4-6,17,19,21H,3,7-12H2,1-2H3
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InChIKey
NQTJOYVQYNTTED-UHFFFAOYSA-N
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CAS Registry Number
53904-98-6
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PubChem CID
185758
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
NQTJOYVQYNTTED-UHFFFAOYSA-N
UniChem compound ID
51040516
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID00968691
1 reference
matched by identifier from
InChIKey
InChIKey
NQTJOYVQYNTTED-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID101396261
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