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(Q105206801)
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English
(6Z,9S,10E)-9-hydroxy-6,10-dimethyl-11-(2-methyl-1,3-thiazol-4-yl)undeca-6,10-dien-3-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
9-Hydroxy-6,10-dimethyl-11-(2-methyl-1,3-thiazol-4-yl)undeca-6,10-dien-3-one
1 reference
based on heuristic
inferred from SMILES
mass
307.16060004
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₇H₂₅NO₂S
0 references
canonical SMILES
O=C(CC)CCC(=CCC(O)C(=CC=1N=C(SC1)C)C)C
0 references
isomeric SMILES
CCC(=O)CC/C(C)=C\C[C@H](O)/C(C)=C/c1csc(C)n1
0 references
found in taxon
Myxococcus xanthus
1 reference
stated in
Isolation and Characterization of New Epothilone Analogues from Recombinant Myxococcus xanthus Fermentations
Identifiers
InChI
InChI=1S/C17H25NO2S/c1-5-16(19)8-6-12(2)7-9-17(20)13(3)10-15-11-21-14(4)18-15/h7,10-11,17,20H,5-6,8-9H2,1-4H3/b12-7-,13-10+/t17-/m0/s1
0 references
InChIKey
PDWXCPOZTNNZCY-PQRNELANSA-N
0 references
PubChem CID
11312847
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
PDWXCPOZTNNZCY-PQRNELANSA-N
ChEBI ID
220763
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C17H25NO2S/c1-5-16(19)8-6-12(2)7-9-17(20)13(3)10-15-11-21-14(4)18-15/h7,10-11,17,20H,5-6,8-9H2,1-4H3/b12-7-,13-10+/t17-/m0/s1
UniChem compound ID
33864148
1 reference
stated in
UniChem
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