Services
Research
Training
Industry
About us
ChEBI
Examples:
iron*
,
InChI=1S/CH4O/c1-2/h2H,1H3
,
caffeine
Advanced
Home
Advanced Search
Browse
Documentation
Download
Tools
About ChEBI
Submit
Contact us
DiNA
Statistics
Entity of the Month
Periodic Table
Ontology
Train online
User Manual
Annotation Manual
Developer Manual
FAQ's
BiNChE
libChEBI
Web Services
ChEBI
> Main
CHEBI:69495 - Sphaeropsidin C
Main
ChEBI Ontology
Automatic Xrefs
Reactions
Pathways
Models
ChEBI Name
Sphaeropsidin C
ChEBI ID
CHEBI:69495
Definition
A natural product found in
Smardaea
species and
Diplodia cupressi
.
Stars
This entity has been manually annotated by a third party.
Supplier Information
No supplier information found for this compound.
Download
Molfile
XML
SDF
Find compounds which contain this structure
Find compounds which resemble this structure
Take structure to the Advanced Search
Formula
C20H28O4
Net Charge
0
Average Mass
332.43390
Monoisotopic Mass
332.19876
InChI
InChI=1S/C20H28O4/c1-
5-
18(4)
9-
10-
20(24)
13(12-
18)
14(21)
11-
15-
17(2,3)
7-
6-
8-
19(15,20)
16(22)
23/h5,12,15,24H,1,6-
11H2,2-
4H3,(H,22,23)
/t15-
,18-
,19-
,20+/m0/s1
InChIKey
VIDNIVWPSMVGJV-MVJPYGJCSA-N
SMILES
[H][C@@]12CC(=O)C3=C[C@](C)(CC[C@]3(O)[C@]1(CCCC2(C)C)C(O)=O)C=C
Metabolite of Species
Details
Smardaea
(NCBI:txid173111)
Ethyl acetate extract,Endophytic fungus in the living photosynthetic tissue of Ceratodon purpureus. of strain AZ0432 See:
PubMed
Xylaria
(NCBI:txid37991)
Ethyl acetate extract of broth, fungus isolated from an undefined dead wood of strain BCC 4297 See:
PubMed
Diplodia cupressi
(NCBI:txid400389)
of strain 261.85CBS 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
Sphaeropsidin C (
CHEBI:69495
)
has role
metabolite (
CHEBI:25212
)
Sphaeropsidin C (
CHEBI:69495
)
is a
tricyclic diterpenoid (
CHEBI:79084
)
Synonym
Source
(13alpha)-9-Hydroxy-7-oxopimara-8(14),15-dien-20-oic acid
ChEBI
Citations
Last Modified
20 May 2016
General Comment
2014-10-17
Suggested Classification: ISA:cyclohexanones(CHEBI:23482); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:tertiary alcohol(CHEBI:26878); ISA:organic hydroxy compound(CHEBI:33822); ISA:monocarboxylic acid(CHEBI:25384); ISA:carboxylic acid(CHEBI:33575); ISA:organonitrogen compound(CHEBI:35352);