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CHEBI:32260 - trilostane
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ChEBI Name
trilostane
ChEBI ID
CHEBI:32260
Definition
An epoxy steroid that is 3,17β-dihydroxy-5α-androst-2-ene-2-carbonitrile in which the oxygen of the epoxy group is joined to the 4α and 5 α positions.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C20H27NO3
Net Charge
0
Average Mass
329.43332
Monoisotopic Mass
329.19909
InChI
InChI=1S/C20H27NO3/c1-
18-
7-
6-
14-
12(13(18)
3-
4-
15(18)
22)
5-
8-
20-
17(24-
20)
16(23)
11(10-
21)
9-
19(14,20)
2/h12-
15,17,22-
23H,3-
9H2,1-
2H3/t12-
,13-
,14-
,15-
,17+,18-
,19+,20+/m0/s1
InChIKey
KVJXBPDAXMEYOA-CXANFOAXSA-N
SMILES
[H][C@@]12CC[C@@]34O[C@@H]3C(O)=C(C[C@]4(C)[C@@]1([H])CC[C@]1(C)[C@@H](O)CC[C@@]21[H])C#N
Roles Classification
Biological Role
(s):
EC 1.1.1.210 [3beta(or 20alpha)-hydroxysteroid dehydrogenase] inhibitor
An EC 1.1.1.* (oxidoreductase acting on donor CH-OH group, NAD
+
or NADP
+
acceptor) inhibitor which interferes with the action of 3
beta
-hydroxysteroid dehydrogenase (EC 1.1.1.210), a group of steroidogenic enzymes.
Application
(s):
antineoplastic agent
A substance that inhibits or prevents the proliferation of neoplasms.
abortifacient
A chemical substance that interrupts pregnancy after implantation.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
trilostane (
CHEBI:32260
)
has role
abortifacient (
CHEBI:50691
)
trilostane (
CHEBI:32260
)
has role
antineoplastic agent (
CHEBI:35610
)
trilostane (
CHEBI:32260
)
has role
EC 1.1.1.210 [3β(or 20α)-hydroxysteroid dehydrogenase] inhibitor (
CHEBI:50788
)
trilostane (
CHEBI:32260
)
is a
17β-hydroxy steroid (
CHEBI:35343
)
trilostane (
CHEBI:32260
)
is a
3-hydroxy steroid (
CHEBI:36834
)
trilostane (
CHEBI:32260
)
is a
androstanoid (
CHEBI:50402
)
trilostane (
CHEBI:32260
)
is a
epoxy steroid (
CHEBI:145217
)
trilostane (
CHEBI:32260
)
is a
nitrile (
CHEBI:18379
)
IUPAC Name
3,17β-dihydroxy-4α,5-epoxy-5α-androst-2-ene-2-carbonitrile
INNs
Sources
trilostane
ChemIDplus
trilostano
ChemIDplus
trilostanum
ChemIDplus
Manual Xrefs
Databases
1891
VSDB
2746
DrugCentral
D01180
KEGG DRUG
DB01108
DrugBank
Trilostane
Wikipedia
US3296255
Patent
View more database links
Registry Number
Type
Source
13647-35-3
CAS Registry Number
KEGG DRUG
Last Modified
28 October 2019