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(Q105302706)
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English
(1R,2R,5R,6S,9S,15R,16R)-16-hydroxy-15-methyl-16-propan-2-yl-3,14-dioxa-11-azapentacyclo[7.5.1.12,5.01,11.06,15]hexadecan-4-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
picrotoxanes
0 references
dendrobane alkaloid
0 references
mass
307.17835828
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₇H₂₅NO₄
0 references
canonical SMILES
O=C1OC2C34OCCN4CC5CCC(C1C2(O)C(C)C)C53C
0 references
isomeric SMILES
CC(C)[C@@]1(O)[C@@H]2C(=O)O[C@H]1[C@@]13OCCN1C[C@H]1CC[C@@H]2[C@]13C
0 references
found in taxon
Dendrobium nobile
1 reference
stated in
Further Studies on the Alkaloidal Constituents of Dendrobium nobile (Orchidaceae)-Structure Determination of 4-Hydroxy-dendroxine and Nobilomethylene
Identifiers
InChI
InChI=1S/C17H25NO4/c1-9(2)16(20)12-11-5-4-10-8-18-6-7-21-17(18,15(10,11)3)14(16)22-13(12)19/h9-12,14,20H,4-8H2,1-3H3/t10-,11+,12+,14-,15+,16-,17+/m1/s1
0 references
InChIKey
WDUVFLGBFJGYSE-AUAZTDMMSA-N
0 references
PubChem CID
154496027
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
WDUVFLGBFJGYSE-AUAZTDMMSA-N
UniChem compound ID
153210744
1 reference
stated in
UniChem
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