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(Q105364349)
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English
2-beta-d-Glucopyranosyloxy-5-butoxyphenylacetic acid
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
2-[5-Butoxy-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]acetic acid
1 reference
based on heuristic
inferred from SMILES
mass
386.157682412
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₈H₂₆O₉
0 references
canonical SMILES
O=C(O)CC1=CC(OCCCC)=CC=C1OC2OC(CO)C(O)C(O)C2O
0 references
isomeric SMILES
CCCCOc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(CC(=O)O)c1
0 references
found in taxon
Entada phaseoloides
1 reference
stated in
Phenylacetic acid derivatives and a thioamide glycoside fromEntada phaseoloides
Identifiers
InChI
InChI=1S/C18H26O9/c1-2-3-6-25-11-4-5-12(10(7-11)8-14(20)21)26-18-17(24)16(23)15(22)13(9-19)27-18/h4-5,7,13,15-19,22-24H,2-3,6,8-9H2,1H3,(H,20,21)/t13-,15-,16+,17-,18-/m1/s1
0 references
InChIKey
YUPREWCDMQAPSL-SOVHRIKKSA-N
0 references
PubChem CID
15108713
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
YUPREWCDMQAPSL-SOVHRIKKSA-N
UniChem compound ID
96660174
1 reference
stated in
UniChem
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