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(Q77569633)
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English
Melithiazol D
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
thiazole alkaloid
0 references
mass
424.149049376
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₂₈N₂O₄S₂
0 references
canonical SMILES
O=C(OC)C=C(OC)C(C)C(OC)C=CC=1N=C(SC1)C2N=C(SC2)C(C)C
0 references
isomeric SMILES
COC(=O)/C=C(/OC)C(C)C(/C=C/c1csc(C2CSC(C(C)C)=N2)n1)OC
1 reference
based on heuristic
inferred from InChI
found in taxon
Archangium gephyra
2 references
stated in
Melithiazols, new beta-methoxyacrylate inhibitors of the respiratory chain isolated from myxobacteria. Production, isolation, physico-chemical and biological properties
stated in
Melithiazols, new beta-methoxyacrylate inhibitors of the respiratory chain isolated from myxobacteria. Production, isolation, physico-chemical and biological properties
Identifiers
InChI
InChI=1S/C20H28N2O4S2/c1-12(2)19-22-15(11-28-19)20-21-14(10-27-20)7-8-16(24-4)13(3)17(25-5)9-18(23)26-6/h7-10,12-13,15-16H,11H2,1-6H3/b8-7+,17-9+
0 references
InChIKey
MKHXEKLNLZKVLK-ITDUAQOSSA-N
2 references
stated in
PubChem
PubChem CID
10502456
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
10502456
language of work or name
English
PubChem CID
10502456
2 references
stated in
PubChem
PubChem CID
10502456
language of work or name
English
matched by identifier from
InChIKey
InChIKey
MKHXEKLNLZKVLK-ITDUAQOSSA-N
ChEBI ID
220909
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C20H28N2O4S2/c1-12(2)19-22-15(11-28-19)20-21-14(10-27-20)7-8-16(24-4)13(3)17(25-5)9-18(23)26-6/h7-10,12-13,15-16H,11H2,1-6H3/b8-7+,17-9+
UniChem compound ID
33789893
1 reference
stated in
UniChem
NMRShiftDB structure ID
70012066
reason for deprecated rank
cannot be confirmed by other sources
0 references
Natural Product Atlas ID
NPA016149
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
MKHXEKLNLZKVLK-ITDUAQOSSA-N
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