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(Q105112634)
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English
isomacarangin
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
2,6-dimethyloctane monoterpenoid
0 references
8C-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(O)=C(OC=2C1=C(O)C=C(O)C2CC=C(C)CCC=C(C)C)C=3C=CC(O)=CC3
0 references
isomeric SMILES
CC(C)=CCC/C(C)=C\Cc1c(O)cc(O)c2c(=O)c(O)c(-c3ccc(O)cc3)oc12
1 reference
based on heuristic
inferred from InChI
found in taxon
Macaranga schweinfurthii
2 references
stated in
A Novel Geranylflavone From Macaranga Schweinfurthii
stated in
A Novel Geranylflavone From Macaranga Schweinfurthii
Identifiers
InChI
InChI=1S/C25H26O6/c1-14(2)5-4-6-15(3)7-12-18-19(27)13-20(28)21-22(29)23(30)24(31-25(18)21)16-8-10-17(26)11-9-16/h5,7-11,13,26-28,30H,4,6,12H2,1-3H3/b15-7-
0 references
InChIKey
IGGXIQKUMBVBRV-CHHVJCJISA-N
0 references
PubChem CID
5352097
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
IGGXIQKUMBVBRV-CHHVJCJISA-N
UniChem compound ID
45357138
1 reference
stated in
UniChem
KNApSAcK ID
C00013516
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
IGGXIQKUMBVBRV-CHHVJCJISA-N
LIPID MAPS ID
LMPK12111987
1 reference
InChIKey
IGGXIQKUMBVBRV-CHHVJCJISA-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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