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(Q104403342)
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Angustifolin
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
Augustifolin
1 reference
based on heuristic
inferred from SMILES
mass
376.188588616
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(1'R,3R,3aS,4S,6'R,7'S,7aS,9'R)-7'-hydroxy-3-methoxy-7a-methyl-10'-methylidenespiro[1,3,3a,5,6,7-hexahydro-2-benzofuran-4,5'-3-oxatricyclo[7.2.1.01,6]dodecane]-2',11'-dione
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
6-Epiangustifolin
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₂₁H₂₈O₆
0 references
canonical SMILES
O=C1OCC2(CCCC3(C)COC(OC)C32)C4C(O)CC5C(=C)C(=O)C14C5
0 references
isomeric SMILES
C=C1C(=O)[C@]23C[C@H]1C[C@@H](O)[C@H]2[C@@]1(CCC[C@@]2(C)CO[C@H](OC)[C@H]21)COC3=O
0 references
found in taxon
Haplophyllum thesioides
1 reference
stated in
Alkaloids and Coumarins From Haplophyllum Thesioides
Dictamnus albus
2 references
stated in
Limonoids and alkaloids of the root bark of Dictamnus angustifolius
stated in
Limonoids and alkaloids of the root bark of Dictamnus angustifolius
Isodon enanderianus
3 references
stated in
Diterpenoids from Isodon enanderianus
stated in
A new ent-kaurane diterpenoid from Isodon japonica
stated in
Diterpenoids from Isodon enanderianus
Isodon rubescens
3 references
stated in
Cytotoxic constituents of Isodon rubescens var. lushiensis.
stated in
Cytotoxic constituents of Isodon rubescens var. lushiensis.
stated in
Cytotoxic constituents of Isodon rubescens var. lushiensis.
Ruta angustifolia
2 references
stated in
Four aromatic derivatives from Ruta angustifolia
stated in
Angustifolin, a coumarin from Ruta angustifolia
Clausena lansium
1 reference
stated in
2,7-dihydroxy-3-formyl-1-(3′-methyl-2′-butenyl)carbazole from Clausena lansium
Identifiers
InChI
InChI=1S/C21H28O6/c1-11-12-7-13(22)14-20(10-27-18(24)21(14,8-12)16(11)23)6-4-5-19(2)9-26-17(25-3)15(19)20/h12-15,17,22H,1,4-10H2,2-3H3/t12-,13-,14+,15-,17+,19+,20-,21+/m1/s1
0 references
InChIKey
OCIBRRBOOBNKJY-CQVBDWECSA-N
0 references
PubChem CID
21575185
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
500847
1 reference
stated in
UniChem
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