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(Q105367522)
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English
isoechinulin B
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
biogenic 2,5-diketopiperazine
0 references
indole alkaloid
0 references
pyrazine alkaloid
0 references
mass
389.210327104
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₄H₂₇N₃O₂
0 references
canonical SMILES
OC1=NC(=CC=2C=3C=C(C=CC3NC2C(C=C)(C)C)CC=C(C)C)C(O)=NC1=C
0 references
isomeric SMILES
C=CC(C)(C)c1[nH]c2ccc(CC=C(C)C)cc2c1/C=c1\nc(O)c(=C)nc1O
1 reference
based on heuristic
inferred from InChI
found in taxon
Aspergillus ruber
2 references
stated in
Aspergillus Toxins
stated in
Alkaloid and Anthraquinone Derivatives Produced by the Marine-Derived Endophytic Fungus Eurotium rubrum
Aspergillus stellatus
1 reference
stated in
Isoechinulin-type alkaloids, variecolorins A-L, from halotolerant Aspergillus variecolor
Penicillium griseofulvum
1 reference
stated in
Three New Indole-Containing Diketopiperazine Alkaloids from a Deep-Ocean Sediment Derived Fungus Penicillium griseofulvum
Identifiers
InChI
InChI=1S/C24H27N3O2/c1-7-24(5,6)21-18(13-20-23(29)25-15(4)22(28)27-20)17-12-16(9-8-14(2)3)10-11-19(17)26-21/h7-8,10-13,26H,1,4,9H2,2-3,5-6H3,(H,25,29)(H,27,28)/b20-13-
0 references
InChIKey
YXEBXGSIECYEQC-MOSHPQCFSA-N
0 references
PubChem CID
44445556
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
426210
1 reference
stated in
UniChem
KNApSAcK ID
C00011290
1 reference
based on heuristic
inferred from InChIKey
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