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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:3945 - Cucurbitacin F
Main
ChEBI Ontology
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ChEBI Name
Cucurbitacin F
ChEBI ID
CHEBI:3945
Stars
This entity has been manually annotated by a third party.
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Formula
C30H46O7
Net Charge
0
Average Mass
518.683
Monoisotopic Mass
518.32435
InChI
InChI=1S/C30H46O7/c1-
25(2,36)
12-
11-
21(33)
30(8,37)
23-
19(32)
14-
27(5)
20-
10-
9-
16-
17(13-
18(31)
24(35)
26(16,3)
4)
29(20,7)
22(34)
15-
28(23,27)
6/h9,11-
12,17-
20,23-
24,31-
32,35-
37H,10,13-
15H2,1-
8H3/b12-
11+/t17-
,18+,19-
,20+,23+,24-
,27+,28-
,29+,30+/m1/s1
InChIKey
AOHIGMQGPFTKQX-QZPKXHNASA-N
SMILES
CC(C)
(O)
\C=C\C(=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@@H]
(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 F (
CHEBI:3945
)
is a
cucurbitacin (
CHEBI:16219
)
Synonym
Source
Cucurbitacin F
KEGG COMPOUND
Manual Xrefs
Databases
C00003687
KNApSAcK
C08798
KEGG COMPOUND
View more database links
Registry Number
Type
Source
5939-57-1
CAS Registry Number
KEGG COMPOUND
Last Modified
28 July 2014