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(Q105276274)
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English
[(1S,12S,13R,14R,15E)-15-ethylidene-5-methoxy-3-methyl-3,17-diazapentacyclo[12.3.1.02,10.04,9.012,17]octadeca-2(10),4(9),5,7-tetraen-13-yl]methanol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
12-Methoxyaffinisine
1 reference
based on heuristic
inferred from SMILES
mass
338.199428072
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₂₆N₂O₂
0 references
canonical SMILES
OCC1C2C(=CC)CN3C(C4=C(C=5C=CC=C(OC)C5N4C)CC31)C2
0 references
isomeric SMILES
C/C=C1/CN2[C@H]3C[C@@H]1[C@@H](CO)[C@@H]2Cc1c3n(C)c2c(OC)cccc12
0 references
found in taxon
Rauvolfia bahiensis
1 reference
stated in
Indole alkaloids from Rauvolfia bahiensis A.DC. (Apocynaceae).
Identifiers
InChI
InChI=1S/C21H26N2O2/c1-4-12-10-23-17-9-15-13-6-5-7-19(25-3)21(13)22(2)20(15)18(23)8-14(12)16(17)11-24/h4-7,14,16-18,24H,8-11H2,1-3H3/b12-4-/t14-,16+,17-,18-/m0/s1
0 references
InChIKey
UODIREBYLLUENO-OONYBVTKSA-N
0 references
PubChem CID
11244657
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
33296216
1 reference
stated in
UniChem
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