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(Q105291920)
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2alpha-Acetoxycostic acid
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
2-[6-(acetyloxy)-4a-methyl-8-methylidene-octahydronaphthalen-2-yl]prop-2-enoic acid
1 reference
based on heuristic
inferred from SMILES
mass
292.167459248
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₇H₂₄O₄
0 references
canonical SMILES
O=C(O)C(=C)C1CCC2(C)CC(OC(=O)C)CC(=C)C2C1
0 references
isomeric SMILES
C=C(C(=O)O)[C@@H]1CC[C@@]2(C)C[C@@H](OC(C)=O)CC(=C)[C@@H]2C1
0 references
found in taxon
Cratystylis conocephala
1 reference
stated in
Eudesmanolides and other constituents from Cratystylis conocephala
Laggera crispata
1 reference
stated in
Eudesmane sesquiterpenes from Laggera pterodonta
Laggera pterodonta
1 reference
stated in
Eudesmane sesquiterpenes from Laggera pterodonta
Identifiers
InChI
InChI=1S/C17H24O4/c1-10-7-14(21-12(3)18)9-17(4)6-5-13(8-15(10)17)11(2)16(19)20/h13-15H,1-2,5-9H2,3-4H3,(H,19,20)/t13-,14+,15+,17+/m1/s1
0 references
InChIKey
VRQZPJKYDDGNOG-AESZEHBQSA-N
0 references
PubChem CID
13995539
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
96957313
1 reference
stated in
UniChem
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