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(Q105386473)
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English
2-[(2R)-2-Acetoxytridecyl]-3-hydroxy-6-methoxy-1,4-benzoquinone
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
1-(2-Hydroxy-5-methoxy-3,6-dioxocyclohexa-1,4-dien-1-yl)tridecan-2-yl acetate
1 reference
based on heuristic
inferred from SMILES
mass
394.235538808
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₂H₃₄O₆
0 references
canonical SMILES
O=C1C=C(OC)C(=O)C(=C1O)CC(OC(=O)C)CCCCCCCCCCC
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isomeric SMILES
CCCCCCCCCCC[C@H](CC1=C(O)C(=O)C=C(OC)C1=O)OC(C)=O
0 references
found in taxon
Ardisia polysticta
1 reference
stated in
Cytotoxic alkyl benzoquinones and alkyl phenols from Ardisia virens
Ardisia virens
1 reference
stated in
Cytotoxic alkyl benzoquinones and alkyl phenols from Ardisia virens
Identifiers
InChI
InChI=1S/C22H34O6/c1-4-5-6-7-8-9-10-11-12-13-17(28-16(2)23)14-18-21(25)19(24)15-20(27-3)22(18)26/h15,17,25H,4-14H2,1-3H3/t17-/m1/s1
0 references
InChIKey
ZYWAVLTZNSYXDF-QGZVFWFLSA-N
0 references
PubChem CID
102163920
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
101047095
1 reference
stated in
UniChem
LIPID MAPS ID
LMPK15050002
1 reference
InChIKey
ZYWAVLTZNSYXDF-QGZVFWFLSA-N
stated in
LIPID MAPS
retrieved
17 April 2021
reference URL
http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download
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