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InChI=1S/CH4O/c1-2/h2H,1H3
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CHEBI:58994 - (+)-catechin monohydrate
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ChEBI Ontology
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ChEBI Name
(+)-catechin monohydrate
ChEBI ID
CHEBI:58994
Definition
The monohydrate of (+)-catechin.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C15H16O7
Net Charge
0
Average Mass
308.28330
Monoisotopic Mass
308.08960
InChI
InChI=1S/C15H14O6.H2O/c16-
8-
4-
11(18)
9-
6-
13(20)
15(21-
14(9)
5-
8)
7-
1-
2-
10(17)
12(19)
3-
7;/h1-
5,13,15-
20H,6H2;1H2/t13-
,15+;/m0./s1
InChIKey
OFUMQWOJBVNKLR-NQQJLSKUSA-N
SMILES
O.O[C@H]1Cc2c(O)cc(O)cc2O[C@@H]1c1ccc(O)c(O)c1
Roles Classification
Application
(s):
geroprotector
Any compound that supports healthy aging, slows the biological aging process, or extends lifespan.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
(+)-catechin monohydrate (
CHEBI:58994
)
has part
(+)-catechin (
CHEBI:15600
)
(+)-catechin monohydrate (
CHEBI:58994
)
has role
geroprotector (
CHEBI:176497
)
(+)-catechin monohydrate (
CHEBI:58994
)
is a
hydrate (
CHEBI:35505
)
IUPAC Name
(2
R
,3
S
)-2-(3,4-dihydroxyphenyl)chromane-3,5,7-triol—water (1/1)
Synonyms
Sources
(+)-catechin hydrate
ChEBI
(2R-trans)-2-(3,4-Dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,5,7-triol monohydrate
ChemIDplus
Catechin hydrate
ChEBI
Manual Xref
Database
97077
ChemSpider
View more database links
Registry Number
Type
Source
88191-48-4
CAS Registry Number
ChemIDplus
Citations
Types
Sources
10651166
PubMed citation
Europe PMC
19501612
PubMed citation
Europe PMC
24048981
PubMed citation
Europe PMC
24266106
PubMed citation
Europe PMC
24825545
PubMed citation
Europe PMC
25218093
PubMed citation
Europe PMC
26653744
PubMed citation
Europe PMC
29458270
PubMed citation
Europe PMC
29604256
PubMed citation
Europe PMC
32613640
PubMed citation
Europe PMC
Last Modified
23 September 2021