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(Q105209213)
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English
Dehydrocrotonin[terpene]
group of stereoisomers with the chemical formula C₁₉H₂₂O₄
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
314.151809184
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₉H₂₂O₄
0 references
canonical SMILES
O=C1OC(C2=COC=C2)CC13C(C)CCC4C(=CC(=O)CC43)C
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isomeric SMILES
CC1=CC(=O)C[C@H]2[C@H]1CC[C@@H](C)C21C[C@H](c2ccoc2)OC1=O
0 references
found in taxon
Croton cajucara
1 reference
stated in
Natural killer cell activity and anti-tumour effects of dehydrocrotonin and its synthetic derivatives.
Identifiers
InChI
InChI=1S/C19H22O4/c1-11-7-14(20)8-16-15(11)4-3-12(2)19(16)9-17(23-18(19)21)13-5-6-22-10-13/h5-7,10,12,15-17H,3-4,8-9H2,1-2H3/t12-,15+,16+,17-,19?/m1/s1
0 references
InChIKey
PHTWCRQCDPNVLQ-IXRJCQGZSA-N
0 references
PubChem CID
403560
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
PHTWCRQCDPNVLQ-IXRJCQGZSA-N
UniChem compound ID
45680647
1 reference
stated in
UniChem
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