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> Main
CHEBI:66394 - minheryin G
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ChEBI Name
minheryin G
ChEBI ID
CHEBI:66394
Definition
An
ent
-kaurane diterpenoid isolated from
Isodon henryi
and has been shown to exhibit cytotoxic activity.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C20H30O5
Net Charge
0
Average Mass
350.44920
Monoisotopic Mass
350.20932
InChI
InChI=1S/C20H30O5/c1-
9-
10-
5-
6-
11-
19(4)
12(18(2,3)
13(21)
8-
14(19)
22)
7-
15(23)
20(11,16(9)
24)
17(10)
25/h10-
15,17,21-
23,25H,1,5-
8H2,2-
4H3/t10-
,11-
,12+,13-
,14-
,15+,17+,19-
,20-
/m0/s1
InChIKey
FURKNFFYNZCRQG-AMIFZCDKSA-N
SMILES
[H]
[C@@]
12CC[C@@]
3([H]
)
[C@]
4(C)
[C@@H]
(O)
C[C@H]
(O)
C(C)
(C)
[C@@]
4([H]
)
C[C@@H]
(O)
[C@]
3([C@@H]
1O)
C(=O)
C2=C
Metabolite of Species
Details
Isodon henryi
(IPNI:448579-1)
Found in leaf
(BTO:0000713)
. 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.
Application
(s):
antineoplastic agent
A substance that inhibits or prevents the proliferation of neoplasms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
minheryin G (
CHEBI:66394
)
has role
antineoplastic agent (
CHEBI:35610
)
minheryin G (
CHEBI:66394
)
has role
metabolite (
CHEBI:25212
)
minheryin G (
CHEBI:66394
)
is a
ent
-kaurane diterpenoid (
CHEBI:36760
)
minheryin G (
CHEBI:66394
)
is a
bridged compound (
CHEBI:35990
)
minheryin G (
CHEBI:66394
)
is a
cyclic ketone (
CHEBI:3992
)
minheryin G (
CHEBI:66394
)
is a
secondary alcohol (
CHEBI:35681
)
minheryin G (
CHEBI:66394
)
is a
tetracyclic diterpenoid (
CHEBI:52557
)
IUPAC Name
(1α,3β,5β,7α,8α,9β,10α,13α,14
R
)-
1,3,7,14-
tetrahydroxykaur-
16-
en-
15-
one
Registry Number
Type
Source
21137669
Reaxys Registry Number
Reaxys
Citation
Type
Source
19031362
PubMed citation
Europe PMC
Last Modified
10 April 2013