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(Q104201988)
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English
4-Hydroxy-5,7-dimethyl-14-[1-(2-methyl-1,3-thiazol-4-yl)prop-1-en-2-yl]-1-oxacyclotetradec-11-ene-2,6-dione
group of stereoisomers with the chemical formula C₂₂H₃₁NO₄S
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Statements
instance of
group of stereoisomers
0 references
subclass of
thiazole alkaloid
1 reference
inferred from
thiazole alkaloid
macrolides
1 reference
inferred from
macrolides
mass
405.1973794719999
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₂H₃₁NO₄S
0 references
canonical SMILES
O=C1OC(C(=CC=2N=C(SC2)C)C)CC=CCCCC(C(=O)C(C)C(O)C1)C
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Identifiers
InChI
InChI=1S/C22H31NO4S/c1-14-9-7-5-6-8-10-20(15(2)11-18-13-28-17(4)23-18)27-21(25)12-19(24)16(3)22(14)26/h6,8,11,13-14,16,19-20,24H,5,7,9-10,12H2,1-4H3
0 references
InChIKey
YQYQTGREIHNPDS-UHFFFAOYSA-N
0 references
PubChem CID
74026074
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
YQYQTGREIHNPDS-UHFFFAOYSA-N
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