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> Main
CHEBI:67521 - (-)-gambogic acid
Main
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ChEBI Name
(-)-gambogic acid
ChEBI ID
CHEBI:67521
Definition
A natural product found in
Garcinia hanburyi
.
Stars
This entity has been manually annotated by a third party.
Supplier Information
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Molfile
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Molfile
Formula
C38H44O8
Net Charge
0
Average Mass
628.75120
Monoisotopic Mass
628.30362
InChI
InChI=1S/C38H44O8/c1-
20(2)
10-
9-
15-
36(8)
16-
14-
24-
29(39)
28-
30(40)
26-
18-
23-
19-
27-
35(6,7)
46-
37(33(23)
41,17-
13-
22(5)
34(42)
43)
38(26,27)
45-
32(28)
25(31(24)
44-
36)
12-
11-
21(3)
4/h10-
11,13-
14,16,18,23,27,39H,9,12,15,17,19H2,1-
8H3,(H,42,43)
/b22-
13-
/t23-
,27+,36-
,37+,38-
/m1/s1
InChIKey
GEZHEQNLKAOMCA-RRZNCOCZSA-N
SMILES
[H]
[C@@]
12C[C@@]
3([H]
)
C(C)
(C)
O[C@@]
(CC=C(C)
C(O)
=O)
(C1=O)
[C@]
31Oc3c(CC=C(C)
C)
c4O[C@]
(C)
(CCC=C(C)
C)
C=Cc4c(O)
c3C(=O)
C1=C2
Metabolite of Species
Details
Garcinia hanburyi
(NCBI:txid231906)
Extract of gamboge,a resin exudate from plant See:
PubMed
Roles Classification
Biological Role
(s):
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
(-)-gambogic acid (
CHEBI:67521
)
has role
metabolite (
CHEBI:25212
)
(-)-gambogic acid (
CHEBI:67521
)
is a
pyranoxanthones (
CHEBI:71238
)
Synonyms
Sources
(2Z)-
4-
[(1S,2S,8R,17S,19R)-
12-
Hydroxy-
8,21,21-
trimethyl-
5-
(3-
methyl-
2-
buten-
1-
yl)-
8-
(4-
methyl-
3-
penten-
1-
yl)-
14,18-
dioxo-
3,7,20-
trioxahexacyclo[15.4.1.0[2,15].0[2,19].0[4,13].0[6,11]]docosa-
4(13),5,9, 11,15-
pentaen-
19-
yl]-
2-
methyl-
2-
butenoic acid
ChEBI
beta-Guttiferin
ChEBI
Guttic acid
ChEBI
Manual Xrefs
Databases
C00002950
KNApSAcK
C10062
KEGG COMPOUND
View more database links
Registry Number
Type
Source
2752-65-0
CAS Registry Number
ChemIDplus
Citation
Type
Source
21486005
PubMed citation
Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17
Suggested Classification: ISA:chromenes(CHEBI:23232); ISA:chromones(CHEBI:23238); ISA:monoterpenoid(CHEBI:25409); ISA:aromatic ketone(CHEBI:76224); ISA:aromatic ether(CHEBI:35618); ISA:phenols(CHEBI:33853); ISA:oxacycle(CHEBI:38104); ISA:cyclohexanones(CHEBI:23482); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:enol(CHEBI:33823); ISA:oxolanes(CHEBI:26912); ISA:polyol(CHEBI:26191); ISA:carboxylic acid(CHEBI:33575); ISA:ether(CHEBI:25698); ISA:monocarboxylic acid(CHEBI:25384); ISA:organonitrogen compound(CHEBI:35352); ISA:aromatic alcohol(CHEBI:33854);