Services
Research
Training
Industry
About us
ChEBI
Examples:
iron*
,
InChI=1S/CH4O/c1-2/h2H,1H3
,
caffeine
Advanced
Home
Advanced Search
Browse
Documentation
Download
Tools
About ChEBI
Submit
Contact us
DiNA
Statistics
Entity of the Month
Periodic Table
Ontology
Train online
User Manual
Annotation Manual
Developer Manual
FAQ's
BiNChE
libChEBI
Web Services
ChEBI
> Main
CHEBI:65378 - albibrissinoside A
Main
ChEBI Ontology
Automatic Xrefs
Reactions
Pathways
Models
ChEBI Name
albibrissinoside A
ChEBI ID
CHEBI:65378
Definition
A disaccharide derivative isolated from the stems of
Albizia julibrissin
that exhibits antioxidant activity.
Stars
This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download
Molfile
XML
SDF
Find compounds which contain this structure
Find compounds which resemble this structure
Take structure to the Advanced Search
Formula
C29H38O17
Net Charge
0
Average Mass
658.60180
Monoisotopic Mass
658.21090
InChI
InChI=1S/C29H38O17/c1-
37-
15-
6-
13(7-
16(38-
2)
20(15)
31)
26(35)
42-
11-
29(36)
12-
43-
28(25(29)
34)
46-
24-
22(33)
21(32)
19(10-
30)
45-
27(24)
44-
14-
8-
17(39-
3)
23(41-
5)
18(9-
14)
40-
4/h6-
9,19,21-
22,24-
25,27-
28,30-
34,36H,10-
12H2,1-
5H3/t19-
,21-
,22+,24-
,25+,27-
,28+,29-
/m1/s1
InChIKey
LBCYGUJDJLOLKR-RRMXGVNISA-N
SMILES
[H]
[C@]
1(OC[C@]
(O)
(COC(=O)
c2cc(OC)
c(O)
c(OC)
c2)
[C@H]
1O)
O[C@@H]
1[C@@H]
(O)
[C@H]
(O)
[C@@H]
(CO)
O[C@H]
1Oc1cc(OC)
c(OC)
c(OC)
c1
Metabolite of Species
Details
Albizia julibrissin
(NCBI:txid3813)
Found in stem
(BTO:0001300)
. Previous component: stem bark; See:
PubMed
Roles Classification
Chemical Role
(s):
radical scavenger
A role played by a substance that can react readily with, and thereby eliminate, radicals.
Biological Role
(s):
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
albibrissinoside A (
CHEBI:65378
)
has functional parent
3,4,5-trimethoxyphenol (
CHEBI:2760
)
albibrissinoside A (
CHEBI:65378
)
has role
metabolite (
CHEBI:25212
)
albibrissinoside A (
CHEBI:65378
)
has role
radical scavenger (
CHEBI:48578
)
albibrissinoside A (
CHEBI:65378
)
is a
β-
D
-glucoside (
CHEBI:22798
)
albibrissinoside A (
CHEBI:65378
)
is a
benzoate ester (
CHEBI:36054
)
albibrissinoside A (
CHEBI:65378
)
is a
disaccharide derivative (
CHEBI:63353
)
albibrissinoside A (
CHEBI:65378
)
is a
methoxybenzenes (
CHEBI:51683
)
IUPAC Name
3,4,5-
trimethoxyphenyl 2-
O
-
[(2
S
,3
R
,4
S
)-
3,4-
dihydroxy-
4-
{[(4-
hydroxy-
3,5-
dimethoxybenzoyl)oxy]methyl}tetrahydrofuran-
2-
yl]-
β-
D
-
glucopyranoside
Synonym
Source
3,4,5-
trimethoxyphenyl-
1-
O
-
β-
D
-
(5-
O
-
syringoyl)-
apiofuranosyl-
(1→2)-
β-
D
-
glucopyranoside
ChEBI
Registry Number
Type
Source
9978781
Reaxys Registry Number
Reaxys
Citations
Types
Sources
15577257
PubMed citation
Europe PMC
18273876
PubMed citation
Europe PMC
Last Modified
31 October 2012