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:16060 - 10-deoxysarpagine
Main
ChEBI Ontology
Automatic Xrefs
Reactions
Pathways
Models
ChEBI Name
10-deoxysarpagine
ChEBI ID
CHEBI:16060
Definition
An indole alkaloid that is sarpagan bearing a hydroxy group at position 17.
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:11301, CHEBI:696
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
C19H22N2O
Net Charge
0
Average Mass
294.39086
Monoisotopic Mass
294.17321
InChI
InChI=1S/C19H22N2O/c1-
2-
11-
9-
21-
17-
8-
14-
12-
5-
3-
4-
6-
16(12)
20-
19(14)
18(21)
7-
13(11)
15(17)
10-
22/h2-
6,13,15,17-
18,20,22H,7-
10H2,1H3/b11-
2-
/t13-
,15+,17+,18-
/m0/s1
InChIKey
VXTDUGOBAOLMED-HDFJDURCSA-N
SMILES
[H]\C(C)=C1/CN2[C@@]3([H])C[C@]1([H])[C@@]([H])(CO)[C@@]2([H])Cc1c3[nH]c2ccccc12
Roles Classification
Chemical Role
(s):
Bronsted base
A molecular entity capable of accepting a hydron from a donor (Br
o
nsted acid).
(via
organic amino compound
)
Biological Role
(s):
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via
alkaloid
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
10-deoxysarpagine (
CHEBI:16060
)
has functional parent
sarpagan (
CHEBI:36312
)
10-deoxysarpagine (
CHEBI:16060
)
is a
indole alkaloid (
CHEBI:38958
)
10-deoxysarpagine (
CHEBI:16060
)
is a
primary alcohol (
CHEBI:15734
)
10-deoxysarpagine (
CHEBI:16060
)
is a
tertiary amino compound (
CHEBI:50996
)
IUPAC Name
sarpagan-17-ol
Synonyms
Sources
10-Deoxysarpagine
KEGG COMPOUND
10-deoxysarpagine
UniProt
Sarpagan-17-ol
KEGG COMPOUND
Manual Xrefs
Databases
C00025193
KNApSAcK
C11635
KEGG COMPOUND
View more database links
Registry Number
Type
Source
604-99-9
CAS Registry Number
KEGG COMPOUND
Last Modified
04 August 2014