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> Main
CHEBI:51415 - calixresorc[4]arene
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ChEBI Ontology
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ChEBI Name
calixresorc[4]arene
ChEBI ID
CHEBI:51415
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C28H24O8
Net Charge
0
Average Mass
488.48536
Monoisotopic Mass
488.14712
InChI
InChI=1S/C28H24O8/c29-
21-
9-
22(30)
14-
1-
13(21)
5-
15-
2-
17(25(33)
10-
23(15)
31)
7-
19-
4-
20(28(36)
12-
27(19)
35)
8-
18-
3-
16(6-
14)
24(32)
11-
26(18)
34/h1-
4,9-
12,29-
36H,5-
8H2
InChIKey
YVGKLVZOQWYWTI-UHFFFAOYSA-N
SMILES
Oc1cc(O)c2Cc3cc(Cc4cc(Cc5cc(Cc1c2)c(O)cc5O)c(O)cc4O)c(O)cc3O
ChEBI Ontology
Outgoing
calixresorc[4]arene (
CHEBI:51415
)
has parent hydride
calix[4]arene (
CHEBI:51202
)
calixresorc[4]arene (
CHEBI:51415
)
is a
calixresorcarene (
CHEBI:51416
)
Incoming
2,8,14,20-tetrapentylcalixresorc[4]arene (
CHEBI:51420
)
has functional parent
calixresorc[4]arene (
CHEBI:51415
)
IUPAC Name
pentacyclo[19.3.1.1
3,7
.1
9,13
.1
15,19
]octacosa-
1(25),3(28),4,6,9(27),10,12,15(26),16,18,21,23-
dodecaene-
4,6,10,12,16,18,22,24-
octol
Synonym
Source
calix[4]resorcinarene
ChEBI
Registry Number
Type
Source
6675733
Beilstein Registry Number
Beilstein
Last Modified
21 January 2009