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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:5372 - Glaucarubolone
Main
ChEBI Ontology
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ChEBI Name
Glaucarubolone
ChEBI ID
CHEBI:5372
Stars
This entity has been manually annotated by a third party.
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Formula
C20H26O8
Net Charge
0
Average Mass
394.416
Monoisotopic Mass
394.16277
InChI
InChI=1S/C20H26O8/c1-
7-
4-
10(21)
15(24)
18(3)
9(7)
5-
11-
19-
6-
27-
20(26,17(18)
19)
14(23)
8(2)
12(19)
13(22)
16(25)
28-
11/h4,8-
9,11-
15,17,22-
24,26H,5-
6H2,1-
3H3/t8-
,9+,11-
,12-
,13-
,14-
,15-
,17-
,18-
,19+,20+/m1/s1
InChIKey
FJHVIRYYVWNHSM-FOSMHHDRSA-N
SMILES
C[C@H]
1[C@@H]
(O)
[C@]
2(O)
OC[C@]
34[C@H]
2[C@@]
2(C)
[C@H]
(O)
C(=O)
C=C(C)
[C@@H]
2C[C@H]
3OC(=O)
[C@H]
(O)
[C@@H]
14
ChEBI Ontology
Outgoing
Glaucarubolone (
CHEBI:5372
)
is a
triterpenoid (
CHEBI:36615
)
Synonym
Source
Glaucarubolone
KEGG COMPOUND
Manual Xrefs
Databases
C00003712
KNApSAcK
C08764
KEGG COMPOUND
View more database links
Registry Number
Type
Source
1990-01-8
CAS Registry Number
KEGG COMPOUND
Last Modified
28 July 2014