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(Q104990745)
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English
Kaurenic acid methyl ester
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
Kaurenoic Acid Methyl Ester
1 reference
based on heuristic
inferred from SMILES
mass
316.240230264
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
Kaur-16-en-19-oic acid methyl ester
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₂₁H₃₂O₂
0 references
canonical SMILES
O=C(OC)C1(C)CCCC2(C)C1CCC34CC(=C)C(CCC32)C4
0 references
isomeric SMILES
C=C1C[C@@]23CC[C@H]4[C@@](C)(CCC[C@@]4(C)C(=O)OC)[C@@H]2CC[C@@H]1C3
0 references
found in taxon
Espeletia grandiflora
1 reference
stated in
Kauranoid dieterpenes in Espeletia grandiflora
Helianthus heterophyllus
1 reference
stated in
Heliangolides, kauranes and other constituents of Helianthus heterophyllus
Identifiers
InChI
InChI=1S/C21H32O2/c1-14-12-21-11-8-16-19(2,17(21)7-6-15(14)13-21)9-5-10-20(16,3)18(22)23-4/h15-17H,1,5-13H2,2-4H3/t15-,16+,17+,19-,20-,21-/m1/s1
0 references
InChIKey
DWTRNJFPDXIFSY-YXEXTMMPSA-N
0 references
PubChem CID
5742847
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
570089
1 reference
stated in
UniChem
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