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ChEBI
> Main
CHEBI:53644 - sequirin C
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ChEBI Ontology
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ChEBI Name
sequirin C
ChEBI ID
CHEBI:53644
Definition
A norlignan that is a derivative of agatharesinol in which the aromatic ring B has an additional hydroxy substituent
ortho
to the one present in the parent compound.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C17H18O5
Net Charge
0
Average Mass
302.32180
Monoisotopic Mass
302.11542
InChI
InChI=1S/C17H18O5/c18-
10-
17(22)
14(12-
4-
8-
15(20)
16(21)
9-
12)
7-
3-
11-
1-
5-
13(19)
6-
2-
11/h1-
9,14,17-
22H,10H2/b7-
3+/t14-
,17+/m0/s1
InChIKey
UWWISKPOVFKUES-SITIDLGXSA-N
SMILES
OC[C@@H](O)[C@@H](\C=C\c1ccc(O)cc1)c1ccc(O)c(O)c1
Metabolite of Species
Details
Metasequoia glyptostroboides
(NCBI:txid3371)
Found in leaf
(BTO:0000713)
. 95% ethanolic extract of air-dried, powdered stems and leaves See:
PubMed
Metasequoia glyptostroboides
(NCBI:txid3371)
Found in stem
(BTO:0001300)
. 95% ethanolic extract of air-dried, powdered stems and leaves See:
PubMed
Roles Classification
Biological Role
(s):
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
(via
norlignan
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
sequirin C (
CHEBI:53644
)
has functional parent
agatharesinol (
CHEBI:53627
)
sequirin C (
CHEBI:53644
)
has role
metabolite (
CHEBI:25212
)
sequirin C (
CHEBI:53644
)
is a
norlignan (
CHEBI:53629
)
IUPAC Name
4-
[(1
S
,2
E
)-
1-
[(1
S
)-
1,2-
dihydroxyethyl]-
3-
(4-
hydroxyphenyl)prop-
2-
en-
1-
yl]benzene-
1,2-
diol
Synonym
Source
sequirin-C
ChEBI
Registry Numbers
Types
Sources
7354895
Beilstein Registry Number
Beilstein
7354895
Reaxys Registry Number
Reaxys
Citations
Types
Sources
11371016
PubMed citation
Europe PMC
11684179
PubMed citation
Europe PMC
15124091
PubMed citation
Europe PMC
IND43826632
Agricola citation
Europe PMC
Last Modified
06 August 2013