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ChEBI
> Main
CHEBI:7513 - neoschaftoside
Main
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ChEBI Name
neoschaftoside
ChEBI ID
CHEBI:7513
Definition
A flavone
C
-glycoside that is apigenin attached to a β-
D
-glucopyranosyl and a β-
L
-arabinopyranosyl residues at positions 6 and 8 respectively via
C
-glycosidic linkage.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C26H28O14
Net Charge
0
Average Mass
564.49210
Monoisotopic Mass
564.14791
InChI
InChI=1S/C26H28O14/c27-
6-
13-
18(32)
21(35)
23(37)
26(40-
13)
15-
19(33)
14-
10(29)
5-
12(8-
1-
3-
9(28)
4-
2-
8)
39-
24(14)
16(20(15)
34)
25-
22(36)
17(31)
11(30)
7-
38-
25/h1-
5,11,13,17-
18,21-
23,25-
28,30-
37H,6-
7H2/t11-
,13+,17-
,18+,21-
,22+,23+,25+,26-
/m0/s1
InChIKey
MMDUKUSNQNWVET-LQYCTPBQSA-N
SMILES
OC[C@H]
1O[C@H]
([C@H]
(O)
[C@@H]
(O)
[C@@H]
1O)
c1c(O)
c([C@H]
2OC[C@H]
(O)
[C@H]
(O)
[C@H]
2O)
c2oc(cc(=O)
c2c1O)
-
c1ccc(O)
cc1
Metabolite of Species
Details
Viola philippica
(NCBI:txid316493)
See:
PubMed
Roles Classification
Biological Role
(s):
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
neoschaftoside (
CHEBI:7513
)
has functional parent
apigenin (
CHEBI:18388
)
neoschaftoside (
CHEBI:7513
)
has role
plant metabolite (
CHEBI:76924
)
neoschaftoside (
CHEBI:7513
)
is a
dihydroxyflavone (
CHEBI:38686
)
neoschaftoside (
CHEBI:7513
)
is a
flavone
C
-glycoside (
CHEBI:83280
)
Synonym
Source
apigenin 6-
C
-
β-
D
-
glucopyranosyl-
8-
C
-
β-
L
-
arabinopyranoside
ChEBI
Manual Xrefs
Databases
C00006382
KNApSAcK
C10110
KEGG COMPOUND
LMPK12110244
LIPID MAPS
View more database links
Registry Numbers
Types
Sources
61328-41-4
CAS Registry Number
KEGG COMPOUND
61328-41-4
CAS Registry Number
ChemIDplus
6581044
Reaxys Registry Number
Reaxys
Citations
Types
Sources
14519932
PubMed citation
Europe PMC
24310066
PubMed citation
Europe PMC
Last Modified
05 June 2015