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(Q105004001)
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2-[(2R,4aR,8R,8aR)-8-hydroxy-4a,8-dimethyl-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl]prop-2-enoic acid
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
2-[(4aR,8R,8aR)-8-hydroxy-4a,8-dimethyl-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl]prop-2-enoic acid
1 reference
based on heuristic
inferred from SMILES
2-(8-Hydroxy-4a,8-dimethyldecahydro-2-naphthalenyl)acrylic acid
1 reference
based on heuristic
inferred from SMILES
mass
252.172544628
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
7-epi-Ilicic acid
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
2-[(2S,4aR,8R,8aR)-8-hydroxy-4a,8-dimethyl-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl]prop-2-enoic acid
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
Ilicic acid
1 reference
based on heuristic
inferred from InChI
2-[(2R,4aR,8R,8aS)-8-hydroxy-4a,8-dimethyl-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl]prop-2-enoic acid
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₅H₂₄O₃
0 references
canonical SMILES
O=C(O)C(=C)C1CCC2(C)CCCC(O)(C)C2C1
0 references
isomeric SMILES
C=C(C(=O)O)[C@@H]1CC[C@@]2(C)CCC[C@@](C)(O)[C@@H]2C1
0 references
found in taxon
Ambrosia ilicifolia
1 reference
stated in
Constituents of Ambrosia ilicifolia (Gray) Payne1,2
Dittrichia graveolens
3 references
stated in
New eudesmane derivatives and other sesquiterpenes from the epigeal parts of Dittrichia graveolens
stated in
Ichthyotoxic sesquiterpenes and xanthanolides from Dittrichia graveolens
stated in
A eudesmanolide and other constituents fromInula graveolens
Laggera alata
1 reference
stated in
Eudesmane derivatives and other sesquiterpenes from Laggera alata
Ophryosporus floribundus
1 reference
stated in
Seco-labdanes and other constituents fromOphryosporus floribundus
Artemisia scotina
1 reference
stated in
Vachanic acid from Artemisia scotina
Heterocoma ekmaniana
1 reference
stated in
Epi-Ililic acid from Alcantara Ekmaniana
Artemisia vachanica
1 reference
stated in
Structure of the sesquiterpene hydroxyacid fromArtemisia vachanica Krasch
Aster himalaicus
1 reference
stated in
Eudesmane sesquiterpenes and other constituents from Aster himalaicus
Flourensia oolepis
1 reference
stated in
Sesquiterpenoids and flavonoids from Flourensia oolepis
Ambrosia salsola
1 reference
stated in
Sesquiterpene lactones of Hymenoclea monogyra
Chiliadenus montanus
1 reference
stated in
Sesqui- and monoterpenes from Jasonia montana
Laggera crispata
2 references
stated in
Eudesmane derivatives from Laggera pterodonta
stated in
Eudesmane sesquiterpenes from Laggera pterodonta
Laggera pterodonta
2 references
stated in
Eudesmane derivatives from Laggera pterodonta
stated in
Eudesmane sesquiterpenes from Laggera pterodonta
Pluchea sagittalis
1 reference
stated in
Eudesmane sesquiterpenoids from Pluchea quitoc
Tessaria absinthioides
1 reference
stated in
Sesquiterpenes from Tessaria absinthioides
Artemisia phaeolepis
1 reference
stated in
A New Eudesmenoic Acid from Artemisia phaeolepis
Iva frutescens
1 reference
stated in
Eudesmane derivatives from Iva frutescens
Iva axillaris
1 reference
stated in
Germination and Growth Inhibitory Sesquiterpenes from Iva axillaris Seeds
Artemisia tournefortiana
1 reference
stated in
Eudesmane derivatives and highly oxygenated monoterpenes from Iranian Artemisia species
Artemisia biennis
1 reference
stated in
Eudesmane derivatives and highly oxygenated monoterpenes from Iranian Artemisia species
Dittrichia viscosa
1 reference
stated in
9-Hydroxynerolidol Esters and Bicyclic Sesquiterpenoids from Dittrichia viscosa
Identifiers
InChI
InChI=1S/C15H24O3/c1-10(13(16)17)11-5-8-14(2)6-4-7-15(3,18)12(14)9-11/h11-12,18H,1,4-9H2,2-3H3,(H,16,17)/t11-,12-,14-,15-/m1/s1
0 references
InChIKey
FXKCXGBBUBCRPU-QHSBEEBCSA-N
0 references
PubChem CID
11876195
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
FXKCXGBBUBCRPU-QHSBEEBCSA-N
ChEBI ID
181639
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C15H24O3/c1-10(13(16)17)11-5-8-14(2)6-4-7-15(3,18)12(14)9-11/h11-12,18H,1,4-9H2,2-3H3,(H,16,17)/t11-,12-,14-,15-/m1/s1
UniChem compound ID
587769
1 reference
stated in
UniChem
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