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(Q110192954)
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English
Isopentyl gentiobioside
group of stereoisomers with the chemical formula C₁₇H₃₂O₁₁
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
412.194461844
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₇H₃₂O₁₁
0 references
canonical SMILES
OCC1OC(OCC2OC(OCCC(C)C)C(O)C(O)C2O)C(O)C(O)C1O
0 references
found in taxon
tomato
1 reference
stated in
Aliphatic and aromatic glycosides from the cell cultures of Lycopersicon esculentum
Identifiers
InChI
InChI=1S/C17H32O11/c1-7(2)3-4-25-16-14(23)13(22)11(20)9(28-16)6-26-17-15(24)12(21)10(19)8(5-18)27-17/h7-24H,3-6H2,1-2H3
0 references
InChIKey
PPIXDGFHKZNFOD-UHFFFAOYSA-N
0 references
PubChem CID
131753153
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
PPIXDGFHKZNFOD-UHFFFAOYSA-N
ChEBI ID
167952
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C17H32O11/c1-7(2)3-4-25-16-14(23)13(22)11(20)9(28-16)6-26-17-15(24)12(21)10(19)8(5-18)27-17/h7-24H,3-6H2,1-2H3
UniChem compound ID
31996873
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0041512
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
PPIXDGFHKZNFOD-UHFFFAOYSA-N
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