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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:3946 - Cucurbitacin H
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ChEBI Ontology
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ChEBI Name
Cucurbitacin H
ChEBI ID
CHEBI:3946
Stars
This entity has been manually annotated by a third party.
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Formula
C30H46O8
Net Charge
0
Average Mass
534.683
Monoisotopic Mass
534.31927
InChI
InChI=1S/C30H46O8/c1-
25(2)
15-
9-
10-
19-
27(5)
13-
18(32)
23(30(8,38)
21(34)
12-
20(33)
26(3,4)
37)
28(27,6)
14-
22(35)
29(19,7)
16(15)
11-
17(31)
24(25)
36/h9,16-
20,23,31-
33,37-
38H,10-
14H2,1-
8H3/t16-
,17+,18-
,19+,20?,23+,27+,28-
,29+,30+/m1/s1
InChIKey
ABNDMUIXCBUBLO-REQJDAJISA-N
SMILES
CC(C)
(O)
C(O)
CC(=O)
[C@]
(C)
(O)
[C@H]
1[C@H]
(O)
C[C@@]
2(C)
[C@@H]
3CC=C4[C@@H]
(C[C@H]
(O)
C(=O)
C4(C)
C)
[C@]
3(C)
C(=O)
C[C@]
12C
Roles Classification
Biological Role
(s):
allelochemical
A class of secondary metabolites developed by many plants to influence the behaviour, growth or survival of herbivores, and thus acting as a defence against herbivory.
(via
cucurbitacin
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
Cucurbitacin H (
CHEBI:3946
)
is a
cucurbitacin (
CHEBI:16219
)
Synonym
Source
Cucurbitacin H
KEGG COMPOUND
Manual Xrefs
Databases
C00003688
KNApSAcK
C08799
KEGG COMPOUND
View more database links
Registry Number
Type
Source
751-96-2
CAS Registry Number
KEGG COMPOUND
Last Modified
28 July 2014