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(Q104984129)
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English
(1R,12S,14S,21R,22S)-14-ethyl-10-oxa-8,18-diazahexacyclo[10.8.1.11,14.02,7.08,21.018,22]docosa-2,4,6-trien-21-ol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
14-Ethyl-10-oxa-8,18-diazahexacyclo[10.8.1.11,14.02,7.08,21.018,22]docosa-2,4,6-trien-21-ol
1 reference
based on heuristic
inferred from SMILES
mass
340.215078136
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₂₈N₂O₂
0 references
canonical SMILES
OC12N3C=4C=CC=CC4C52CCN6CCCC(CC)(CC1COC3)C65
0 references
isomeric SMILES
CC[C@]12CCCN3CC[C@@]4(c5ccccc5N5COC[C@H](C1)[C@]54O)[C@@H]32
0 references
found in taxon
Kopsia arborea
1 reference
stated in
Two new aspidosperma indole alkaloids from Yunnan Kopsia arborea
Kopsia officinalis
1 reference
stated in
Two new aspidosperma indole alkaloids from Yunnan Kopsia arborea
Identifiers
InChI
InChI=1S/C21H28N2O2/c1-2-19-8-5-10-22-11-9-20(18(19)22)16-6-3-4-7-17(16)23-14-25-13-15(12-19)21(20,23)24/h3-4,6-7,15,18,24H,2,5,8-14H2,1H3/t15-,18-,19-,20+,21+/m0/s1
0 references
InChIKey
DLCMASBBPKCQAO-NVYAHWSDSA-N
0 references
PubChem CID
162948905
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
DLCMASBBPKCQAO-NVYAHWSDSA-N
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