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(Q110172416)
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English
Rubrumline K
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chaetocin-like alkaloid
1 reference
based on heuristic
inferred from SMILES
mass
369.168856216
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₂₃N₃O₄
0 references
canonical SMILES
O=C1NC(OC)(C(=O)NC1=CC=2C=3C=CC=CC3NC2C(C=C)(C)C)CO
0 references
isomeric SMILES
C=CC(C)(C)c1[nH]c2ccccc2c1/C=C1\NC(=O)[C@@](CO)(OC)NC1=O
0 references
found in taxon
Aspergillus ruber
1 reference
stated in
Neoechinulin B and its analogues as potential entry inhibitors of influenza viruses, targeting viral hemagglutinin
Identifiers
InChI
InChI=1S/C20H23N3O4/c1-5-19(2,3)16-13(12-8-6-7-9-14(12)21-16)10-15-17(25)23-20(11-24,27-4)18(26)22-15/h5-10,21,24H,1,11H2,2-4H3,(H,22,26)(H,23,25)/b15-10-/t20-/m1/s1
0 references
InChIKey
VCCYZSJJWBGBNJ-CKOFDZGGSA-N
0 references
PubChem CID
118734975
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
ChEBI ID
217836
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C20H23N3O4/c1-5-19(2,3)16-13(12-8-6-7-9-14(12)21-16)10-15-17(25)23-20(11-24,27-4)18(26)22-15/h5-10,21,24H,1,11H2,2-4H3,(H,22,26)(H,23,25)/b15-10-/t20-/m1/s1
UniChem compound ID
144620436
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA032359
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
VCCYZSJJWBGBNJ-CKOFDZGGSA-N
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