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CHEBI:132342 - triptohypol E
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ChEBI Name
triptohypol E
ChEBI ID
CHEBI:132342
Definition
A pentacyclic diterpenoid with formula C
31
H
52
O
2
, originally isolated from the root bark of
Tripterygium hypoglaucum
.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
qingping liu
Supplier Information
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Formula
C31H52O2
Net Charge
0
Average Mass
456.745
Monoisotopic Mass
456.39673
InChI
InChI=1S/C31H52O2/c1-
19-
10-
13-
28(5)
16-
17-
30(7)
21(25(28)
20(19)
2)
18-
22(33-
9)
26-
29(6)
14-
12-
24(32)
27(3,4)
23(29)
11-
15-
31(26,30)
8/h18-
20,22-
26,32H,10-
17H2,1-
9H3/t19-
,20+,22-
,23+,24+,25+,26-
,28-
,29+,30-
,31-
/m1/s1
InChIKey
DNPBJHZABOJXGA-HPBGPLOVSA-N
SMILES
O([C@H]
1[C@]
2([C@]
([C@]
3(C([C@]
4([C@@]
(CC3)
(CC[C@H]
([C@@H]
4C)
C)
C)
[H]
)
=C1)
C)
(CC[C@@]
5([C@@]
2(CC[C@H]
(O)
C5(C)
C)
C)
[H]
)
C)
[H]
)
C
Metabolite of Species
Details
Tripterygium hypoglaucum
(NCBI:txid205465)
Found in root
(BTO:0001188)
. 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
triptohypol E (
CHEBI:132342
)
has parent hydride
ursane (
CHEBI:35711
)
triptohypol E (
CHEBI:132342
)
has role
plant metabolite (
CHEBI:76924
)
triptohypol E (
CHEBI:132342
)
is a
ether (
CHEBI:25698
)
triptohypol E (
CHEBI:132342
)
is a
pentacyclic triterpenoid (
CHEBI:25872
)
triptohypol E (
CHEBI:132342
)
is a
secondary alcohol (
CHEBI:35681
)
IUPAC Name
(3β,11α)-11-methoxyurs-12-en-3-ol
Synonym
Source
3β-hydroxy-11α-methoxyurs-12-ene
ChEBI
Registry Number
Type
Source
8524798
Reaxys Registry Number
Reaxys
Citation
Type
Source
10746886
PubMed citation
Europe PMC
Last Modified
21 October 2016