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:50296 - 9-deoxyforskolin
Main
ChEBI Ontology
Automatic Xrefs
Reactions
Pathways
Models
ChEBI Name
9-deoxyforskolin
ChEBI ID
CHEBI:50296
Stars
This entity has been manually annotated by the ChEBI Team.
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
C22H34O6
Net Charge
0
Average Mass
394.50176
Monoisotopic Mass
394.23554
InChI
InChI=1S/C22H34O6/c1-
8-
20(5)
11-
13(24)
16-
21(6)
14(25)
9-
10-
19(3,4)
17(21)
15(26)
18(27-
12(2)
23)
22(16,7)
28-
20/h8,14-
18,25-
26H,1,9-
11H2,2-
7H3/t14-
,15-
,16+,17-
,18-
,20-
,21+,22-
/m0/s1
InChIKey
SUZLHDUTVMZSEV-WESICCPUSA-N
SMILES
[H][C@@]12[C@H](O)[C@H](OC(C)=O)[C@@]3(C)O[C@](C)(CC(=O)[C@]3([H])[C@@]1(C)[C@@H](O)CCC2(C)C)C=C
ChEBI Ontology
Outgoing
9-deoxyforskolin (
CHEBI:50296
)
is a
labdane diterpenoid (
CHEBI:36770
)
IUPAC Name
(3
R
,4a
R
,5
S
,6
S
,6a
S
,10
S
,10a
S
,10b
S
)-
3-
ethenyl-
6,10-
dihydroxy-
3,4a,7,7,10a-
pentamethyl-
1-
oxododecahydro-
1
H
-
benzo[
f
]chromen-
5-
yl acetate
Synonym
Source
7β-acetoxy-8,13-epoxy-1α,6β-dihydroxylabd-14-en-11-one
ChEBI
Registry Number
Type
Source
5999164
Beilstein Registry Number
Beilstein
Last Modified
18 July 2008