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(Q104969707)
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7-Megastigmene-3,5,6,9-tetraol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
1-(3-Hydroxybut-1-enyl)-2,6,6-trimethylcyclohexane-1,2,4-triol
1 reference
based on heuristic
inferred from SMILES
mass
244.167459248
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(1R,2R,4S)-1-[(1E,3R)-3-hydroxybut-1-en-1-yl]-2,6,6-trimethylcyclohexane-1,2,4-triol
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(1S,2S,4R)-1-[(3S)-3-hydroxybut-1-enyl]-2,6,6-trimethylcyclohexane-1,2,4-triol
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
1-[(1E,3S)-3-Hydroxy-1-butenyl]-2,6,6-trimethylcyclohexane-1alpha,2beta,4alpha-triol
1 reference
based on heuristic
inferred from InChI
4-O-p-coumaroyl-D-glucose, 2-O-acetate
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₃H₂₄O₄
0 references
canonical SMILES
OC(C=CC1(O)C(O)(C)CC(O)CC1(C)C)C
0 references
isomeric SMILES
C[C@H](O)/C=C/[C@@]1(O)C(C)(C)C[C@H](O)C[C@@]1(C)O
0 references
found in taxon
Ovatus malisuctus
1 reference
stated in
Inhibitory constituents of Euscaphis japonica on lipopolysaccharide-induced nitric oxide production in BV2 microglia.
Euscaphis japonica
2 references
stated in
Inhibitory constituents of Euscaphis japonica on lipopolysaccharide-induced nitric oxide production in BV2 microglia.
stated in
New megastigmane and tetraketide from the leaves of Euscaphis japonica
Staphylea japonica
2 references
stated in
Inhibitory constituents of Euscaphis japonica on lipopolysaccharide-induced nitric oxide production in BV2 microglia.
stated in
New megastigmane and tetraketide from the leaves of Euscaphis japonica
Isodon sculponeatus
1 reference
stated in
A new phenylethanoid glycoside from Isodon sculponeatus
Saussurea cordifolia
1 reference
stated in
Chemical constituents from Saussurea cordifolia
Staphylea ternata
1 reference
stated in
Turpinionosides A-E: megastigmane glucosides from leaves of Turpinia ternata Nakai
Identifiers
InChI
InChI=1S/C13H24O4/c1-9(14)5-6-13(17)11(2,3)7-10(15)8-12(13,4)16/h5-6,9-10,14-17H,7-8H2,1-4H3/b6-5+/t9-,10-,12+,13+/m0/s1
0 references
InChIKey
CTCKPFXFWVNGLG-DWFSUXBBSA-N
0 references
PubChem CID
637237
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
1036114
1 reference
stated in
UniChem
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