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:70609 - feselol
Main
ChEBI Ontology
Automatic Xrefs
Reactions
Pathways
Models
ChEBI Name
feselol
ChEBI ID
CHEBI:70609
Definition
A natural product found in
Ferula gumosa
.
Stars
This entity has been manually annotated by a third party.
Supplier Information
Download
Molfile
XML
SDF
Find compounds which contain this structure
Find compounds which resemble this structure
Take structure to the Advanced Search
Formula
C24H30O4
Net Charge
0
Average Mass
382.49260
Monoisotopic Mass
382.21441
InChI
InChI=1S/C24H30O4/c1-
15-
5-
9-
20-
23(2,3)
21(25)
11-
12-
24(20,4)
18(15)
14-
27-
17-
8-
6-
16-
7-
10-
22(26)
28-
19(16)
13-
17/h5-
8,10,13,18,20-
21,25H,9,11-
12,14H2,1-
4H3/t18-
,20-
,21-
,24+/m1/s1
InChIKey
MCTDXPDDZLFJHR-XLRKYUMYSA-N
SMILES
[H][C@]12CC=C(C)[C@@H](COc3ccc4ccc(=O)oc4c3)[C@]1(C)CC[C@@H](O)C2(C)C
Metabolite of Species
Details
Ferula gumosa
(NCBI:txid371349)
Found in root
(BTO:0001188)
. The plant powder was extracted with MeOH 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
feselol (
CHEBI:70609
)
has role
metabolite (
CHEBI:25212
)
feselol (
CHEBI:70609
)
is a
coumarins (
CHEBI:23403
)
Synonyms
Sources
7-
[[(1R,4aS,6R,8aR)-
6-
hydroxy-
2,5,5,8a-
tetramethyl-
1,4,4a,6,7,8-
hexahydronaphthalen-
1-
yl]methoxy]chromen-
2-
one
ChEBI
Moschatol
ChEBI
Registry Number
Type
Source
51020-36-1
CAS Registry Number
ChemIDplus
Citation
Type
Source
20961138
PubMed citation
Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17
Suggested Classification: ISA:1-benzopyran(CHEBI:38443); ISA:aromatic ether(CHEBI:35618); ISA:pyranone(CHEBI:37963); ISA:benzenoid aromatic compound(CHEBI:33836); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:organic hydroxy compound(CHEBI:33822); ISA:secondary alcohol(CHEBI:35681); ISA:lactone(CHEBI:25000);