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albanin E
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
2,6-dimethyloctane monoterpenoid
0 references
6C-substituted flavone
0 references
mass
422.172938552
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₅H₂₆O₆
0 references
canonical SMILES
O=C1C=C(OC2=CC(O)=C(C(O)=C12)CC=C(C)CCC=C(C)C)C=3C=CC(O)=CC3O
0 references
isomeric SMILES
CC(C)=CCC/C(C)=C/Cc1c(O)cc2oc(-c3ccc(O)cc3O)cc(=O)c2c1O
1 reference
based on heuristic
inferred from InChI
found in taxon
Morus alba
1 reference
stated in
Revised Structures of Albanins D and E, Geranylated Flavones from Morus alba
Brosimum lactescens
1 reference
stated in
Structures of three new flavone derivatives, brosimones G, H, and I, from Brosimopsis oblongifolia
Morus nigra
1 reference
stated in
Three new compounds from Morus nigra L.
Identifiers
InChI
InChI=1S/C25H26O6/c1-14(2)5-4-6-15(3)7-9-18-20(28)12-23-24(25(18)30)21(29)13-22(31-23)17-10-8-16(26)11-19(17)27/h5,7-8,10-13,26-28,30H,4,6,9H2,1-3H3/b15-7+
0 references
InChIKey
CNACUOPDTBOMCZ-VIZOYTHASA-N
0 references
PubChem CID
21591197
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CNACUOPDTBOMCZ-VIZOYTHASA-N
ChEBI ID
175385
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C25H26O6/c1-14(2)5-4-6-15(3)7-9-18-20(28)12-23-24(25(18)30)21(29)13-22(31-23)17-10-8-16(26)11-19(17)27/h5,7-8,10-13,26-28,30H,4,6,9H2,1-3H3/b15-7+
SureChEMBL ID
SCHEMBL24075639
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CNACUOPDTBOMCZ-VIZOYTHASA-N
UniChem compound ID
32002031
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0038879
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CNACUOPDTBOMCZ-VIZOYTHASA-N
KNApSAcK ID
C00004027
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CNACUOPDTBOMCZ-VIZOYTHASA-N
LIPID MAPS ID
LMPK12110894
1 reference
InChIKey
CNACUOPDTBOMCZ-VIZOYTHASA-N
stated in
LIPID MAPS
retrieved
17 April 2021
reference URL
http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download
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