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Lapidin
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
3-hydroxy-3-isopropyl-6,8a-dimethyl-8-oxo-2,3a,4,5-tetrahydro-1H-azulen-4-yl 2-methylbut-2-enoate
1 reference
based on heuristic
inferred from SMILES
mass
334.21440944
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
[(3R,3aS,4S,8aS)-3-hydroxy-6,8a-dimethyl-8-oxo-3-propan-2-yl-2,3a,4,5-tetrahydro-1H-azulen-4-yl] (Z)-2-methylbut-2-enoate
1 reference
based on heuristic
inferred from InChI
[(3R,3aR,4S,8aS)-3-hydroxy-6,8a-dimethyl-8-oxo-3-propan-2-yl-2,3a,4,5-tetrahydro-1H-azulen-4-yl] (Z)-2-methylbut-2-enoate
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₀H₃₀O₄
0 references
canonical SMILES
O=C(OC1CC(=CC(=O)C2(C)CCC(O)(C(C)C)C12)C)C(=CC)C
0 references
isomeric SMILES
C/C=C(\C)C(=O)O[C@H]1CC(C)=CC(=O)[C@@]2(C)CC[C@@](O)(C(C)C)[C@H]12
0 references
found in taxon
Ferula linkii
2 references
stated in
Sesquiterpene esters and sesquiterpene coumarin ethers from Ferula linkii-TF
stated in
Antinociceptive, anti-inflammatory and antipyretic effects of lapidin, a bicyclic sesquiterpene
Ferula lapidosa
2 references
stated in
Structure and stereochemistry of lapidin
stated in
Terpenoids ofFerula lapidosa
Ferula ovina
2 references
stated in
Structure and stereochemistry of lapidin
stated in
Terpenoids ofFerula lapidosa
Ferula latipinna
1 reference
stated in
Humulenes and Other Constituents of Ferula latipinna
Identifiers
InChI
InChI=1S/C20H30O4/c1-7-14(5)18(22)24-15-10-13(4)11-16(21)19(6)8-9-20(23,12(2)3)17(15)19/h7,11-12,15,17,23H,8-10H2,1-6H3/b14-7+/t15-,17+,19+,20+/m0/s1
0 references
InChIKey
YMWBTMBPEHUMBA-FAKHFBMMSA-N
0 references
PubChem CID
11872435
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
YMWBTMBPEHUMBA-FAKHFBMMSA-N
UniChem compound ID
12781972
1 reference
stated in
UniChem
MassBank accession ID
MSBNK-RIKEN_NPDepo-CB000450
1 reference
InChIKey
YMWBTMBPEHUMBA-FAKHFBMMSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-RIKEN_NPDepo-NGA01613
1 reference
InChIKey
YMWBTMBPEHUMBA-FAKHFBMMSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-RIKEN_NPDepo-NGA01614
1 reference
InChIKey
YMWBTMBPEHUMBA-FAKHFBMMSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-RIKEN_NPDepo-NGA01615
1 reference
InChIKey
YMWBTMBPEHUMBA-FAKHFBMMSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-RIKEN_NPDepo-NGA01616
1 reference
InChIKey
YMWBTMBPEHUMBA-FAKHFBMMSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
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