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(Q105209711)
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English
Leucasperol A
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
labdanes
0 references
mass
352.224974124
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
Leucasperol B
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₀H₃₂O₅
0 references
canonical SMILES
O=C1CC(C)C2(OC3(CCOC3O)CC2)C4(C)CCC(O)C(C)(C)C14
0 references
isomeric SMILES
C[C@@H]1CC(=O)[C@H]2C(C)(C)[C@@H](O)CC[C@]2(C)[C@@]12CC[C@@]1(CCO[C@H]1O)O2
0 references
found in taxon
Leucas aspera
1 reference
stated in
Diterpenes from Leucas aspera inhibiting prostaglandin-induced contractions
Identifiers
InChI
InChI=1S/C20H32O5/c1-12-11-13(21)15-17(2,3)14(22)5-6-18(15,4)20(12)8-7-19(25-20)9-10-24-16(19)23/h12,14-16,22-23H,5-11H2,1-4H3/t12-,14+,15+,16-,18+,19+,20-/m1/s1
0 references
InChIKey
PITIZJDONNHGKA-KXOMVGNFSA-N
0 references
PubChem CID
11844109
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
PITIZJDONNHGKA-KXOMVGNFSA-N
UniChem compound ID
32346205
1 reference
stated in
UniChem
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