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(Q105367774)
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English
Langduin B
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
6,10a,11-Trihydroxy-8-(hydroxymethyl)-4,4,11b-trimethyl-1,2,3,4a,5,6,11,11a-octahydronaphtho[2,1-f][1]benzofuran-9-one
1 reference
based on heuristic
inferred from SMILES
mass
364.188588616
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₂₈O₆
0 references
canonical SMILES
O=C1OC2(O)C(C=C3C(O)CC4C(C)(C)CCCC4(C)C3C2O)=C1CO
0 references
isomeric SMILES
CC1(C)CCC[C@@]2(C)[C@H]3C(=CC4=C(CO)C(=O)O[C@@]4(O)[C@@H]3O)[C@@H](O)C[C@H]12
0 references
found in taxon
Euphorbia fischeriana
3 references
stated in
Diterpenes and aromatic compounds from Euphorbia fischeriana
stated in
Diterpenes and aromatic compounds from Euphorbia fischeriana
stated in
Diterpenes and aromatic compounds from Euphorbia fischeriana
Identifiers
InChI
InChI=1S/C20H28O6/c1-18(2)5-4-6-19(3)14(18)8-13(22)10-7-12-11(9-21)17(24)26-20(12,25)16(23)15(10)19/h7,13-16,21-23,25H,4-6,8-9H2,1-3H3/t13-,14+,15-,16+,19+,20+/m0/s1
0 references
InChIKey
YXLWTUIPFPTBEL-QQPVWDQJSA-N
0 references
PubChem CID
10784988
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
YXLWTUIPFPTBEL-QQPVWDQJSA-N
UniChem compound ID
34477823
1 reference
stated in
UniChem
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