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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:33091 - ovalene
Main
ChEBI Ontology
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ChEBI Name
ovalene
ChEBI ID
CHEBI:33091
Stars
This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download
Molfile
XML
SDF
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Molfile
Formula
C32H14
Net Charge
0
Average Mass
398.45356
Monoisotopic Mass
398.10955
InChI
InChI=1S/C32H14/c1-
2-
16-
6-
10-
20-
14-
22-
12-
8-
18-
4-
3-
17-
7-
11-
21-
13-
19-
9-
5-
15(1)
23-
24(16)
28(20)
32-
30(22)
26(18)
25(17)
29(21)
31(32)
27(19)
23/h1-
14H
InChIKey
LSQODMMMSXHVCN-UHFFFAOYSA-N
SMILES
c1cc2ccc3cc4ccc5ccc6ccc7cc8ccc1c1c2c3c2c4c5c6c7c2c81
Roles Classification
Biological Role
(s):
carcinogenic agent
A role played by a chemical compound which is known to induce a process of carcinogenesis by corrupting normal cellular pathways, leading to the acquistion of tumoral capabilities.
(via
polycyclic arene
)
Application
(s):
endocrine disruptor
Any compound that can disrupt the functions of the endocrine (hormone) system
(via
polycyclic arene
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
ovalene (
CHEBI:33091
)
is a
ortho
- and
peri
-fused polycyclic arene (
CHEBI:35300
)
IUPAC Name
ovalene
Registry Numbers
Types
Sources
1621193
Gmelin Registry Number
Gmelin
1893486
Beilstein Registry Number
Beilstein
190-26-1
CAS Registry Number
NIST Chemistry WebBook
190-26-1
CAS Registry Number
ChemIDplus
Last Modified
16 September 2006