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Perilloside A
chemical compound
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No description defined
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Statements
instance of
type of chemical entity
0 references
subclass of
2-(Hydroxymethyl)-6-[(4-prop-1-en-2-ylcyclohexen-1-yl)methoxy]oxane-3,4,5-triol
1 reference
based on heuristic
inferred from SMILES
mass
314.172938552
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₆H₂₆O₆
0 references
canonical SMILES
OCC1OC(OCC2=CCC(C(=C)C)CC2)C(O)C(O)C1O
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isomeric SMILES
CC(=C)[C@H]1CCC(=CC1)CO[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O
0 references
found in taxon
Perilla frutescens
2 references
stated in
Perilloside a, a monoterpene glucoside from Perilla frutescens
stated in
Perilloside a, a monoterpene glucoside from Perilla frutescens
Identifiers
InChI
InChI=1S/C16H26O6/c1-9(2)11-5-3-10(4-6-11)8-21-16-15(20)14(19)13(18)12(7-17)22-16/h3,11-20H,1,4-8H2,2H3/t11-,12-,13-,14+,15-,16-/m1/s1
0 references
InChIKey
YUTAFQVKXLDYFG-YTQIUSBHSA-N
0 references
CAS Registry Number
141206-20-4
0 references
PubChem CID
3086657
1 reference
matched by identifier from
InChIKey
InChIKey
YUTAFQVKXLDYFG-YTQIUSBHSA-N
ChEBI ID
175044
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C16H26O6/c1-9(2)11-5-3-10(4-6-11)8-21-16-15(20)14(19)13(18)12(7-17)22-16/h3,11-20H,1,4-8H2,2H3/t11-,12-,13-,14+,15-,16-/m1/s1
UniChem compound ID
33154142
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID00931027
1 reference
matched by identifier from
InChIKey
InChIKey
YUTAFQVKXLDYFG-YTQIUSBHSA-N
DSSTOX compound identifier
DTXCID101359742
0 references
KNApSAcK ID
C00059877
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
YUTAFQVKXLDYFG-YTQIUSBHSA-N
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