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ChEBI
> Main
CHEBI:70417 - friedelin-3,4-lactone
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ChEBI Ontology
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ChEBI Name
friedelin-3,4-lactone
ChEBI ID
CHEBI:70417
Definition
A pentacyclic triterpenoid isolated from the leaves of
Garcia parviflora
.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C30H50O2
Net Charge
0
Average Mass
442.71680
Monoisotopic Mass
442.38108
InChI
InChI=1S/C30H50O2/c1-
20-
27(5)
12-
11-
22-
28(6,21(27)
9-
10-
24(31)
32-
20)
16-
18-
30(8)
23-
19-
25(2,3)
13-
14-
26(23,4)
15-
17-
29(22,30)
7/h20-
23H,9-
19H2,1-
8H3/t20-
,21-
,22+,23-
,26-
,27-
,28+,29-
,30+/m1/s1
InChIKey
UYYLYVBSUPHXSX-PFTFKKIYSA-N
SMILES
C[C@H]1OC(=O)CC[C@H]2[C@]3(C)CC[C@@]4(C)[C@@H]5CC(C)(C)CC[C@]5(C)CC[C@]4(C)[C@H]3CC[C@]12C
Metabolite of Species
Details
Garcia parviflora
(IPNI:107401-2)
Found in leaf
(BTO:0000713)
. n-hexane extract of air-dried, powdered branch and leaves See:
PubMed
Garcia parviflora
(IPNI:107401-2)
Found in branch
(BTO:0000148)
. n-hexane extract of air-dried, powdered branch and leaves See:
PubMed
ChEBI Ontology
Outgoing
friedelin-3,4-lactone (
CHEBI:70417
)
has functional parent
friedelin (
CHEBI:5171
)
friedelin-3,4-lactone (
CHEBI:70417
)
is a
ε-lactone (
CHEBI:50239
)
friedelin-3,4-lactone (
CHEBI:70417
)
is a
pentacyclic triterpenoid (
CHEBI:25872
)
friedelin-3,4-lactone (
CHEBI:70417
)
is a
terpene lactone (
CHEBI:37668
)
IUPAC Name
(5
R
,5a
S
,7a
S
,7b
R
,9a
R
,13a
R
,13b
S
,15a
R
,15b
S
)-
5,5a,7b,9a,12,12,13b,15a-
octamethylicosahydrochryseno[2,1-
c
]oxepin-
3(2
H
)-
one
Registry Number
Type
Source
44179
Reaxys Registry Number
Reaxys
Citation
Type
Source
20958014
PubMed citation
Europe PMC
Last Modified
01 June 2015