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> Main
CHEBI:70993 - 6-pentadecylbenzene-1,2,4-triol
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ChEBI Ontology
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ChEBI Name
6-pentadecylbenzene-1,2,4-triol
ChEBI ID
CHEBI:70993
Definition
A benzenetriol that is benzene-1,2,4-triol substituted by a pentadecyl group at position 6.
Stars
This entity has been manually annotated by the ChEBI Team.
Supplier Information
ZINC000066102567
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Formula
C21H36O3
Net Charge
0
Average Mass
336.50870
Monoisotopic Mass
336.26645
InChI
InChI=1S/C21H36O3/c1-
2-
3-
4-
5-
6-
7-
8-
9-
10-
11-
12-
13-
14-
15-
18-
16-
19(22)
17-
20(23)
21(18)
24/h16-
17,22-
24H,2-
15H2,1H3
InChIKey
ZUFMUVHSZVGTJI-UHFFFAOYSA-N
SMILES
CCCCCCCCCCCCCCCc1cc(O)cc(O)c1O
ChEBI Ontology
Outgoing
6-pentadecylbenzene-1,2,4-triol (
CHEBI:70993
)
is a
benzenetriol (
CHEBI:22707
)
Incoming
ardisiphenol A (
CHEBI:65430
)
has functional parent
6-pentadecylbenzene-1,2,4-triol (
CHEBI:70993
)
IUPAC Name
6-pentadecylbenzene-1,2,4-triol
Last Modified
12 November 2012