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ChEBI
> Main
CHEBI:9775 - tubulosine
Main
ChEBI Ontology
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ChEBI Name
tubulosine
ChEBI ID
CHEBI:9775
Definition
A member of the class of β-carbolines that is tubulosan bearing methoxy groups at positions 10 and 11 and a hydroxy group at the 8' position.
Stars
This entity has been manually annotated by the ChEBI Team.
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Molfile
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Molfile
Formula
C29H37N3O3
Net Charge
0
Average Mass
475.62250
Monoisotopic Mass
475.28349
InChI
InChI=1S/C29H37N3O3/c1-
4-
17-
16-
32-
10-
8-
18-
13-
27(34-
2)
28(35-
3)
15-
22(18)
26(32)
12-
19(17)
11-
25-
29-
21(7-
9-
30-
25)
23-
14-
20(33)
5-
6-
24(23)
31-
29/h5-
6,13-
15,17,19,25-
26,30-
31,33H,4,7-
12,16H2,1-
3H3/t17-
,19-
,25+,26-
/m0/s1
InChIKey
JRVWIILYWSBUMC-PRUVNFMMSA-N
SMILES
[H][C@]1(C[C@@]2([H])NCCc3c2[nH]c2ccc(O)cc32)C[C@]2([H])N(CCc3cc(OC)c(OC)cc23)C[C@@H]1CC
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
tubulosine (
CHEBI:9775
)
has parent hydride
tubulosan (
CHEBI:36379
)
tubulosine (
CHEBI:9775
)
is a
β-carbolines (
CHEBI:60834
)
tubulosine (
CHEBI:9775
)
is a
isoquinoline alkaloid (
CHEBI:24921
)
tubulosine (
CHEBI:9775
)
is a
isoquinolines (
CHEBI:24922
)
tubulosine (
CHEBI:9775
)
is a
phenols (
CHEBI:33853
)
tubulosine (
CHEBI:9775
)
is a
secondary amino compound (
CHEBI:50995
)
tubulosine (
CHEBI:9775
)
is a
tertiary amino compound (
CHEBI:50996
)
IUPAC Name
10,11-dimethoxytubulosan-8'-ol
Synonym
Source
Tubulosine
KEGG COMPOUND
Manual Xrefs
Databases
C00001778
KNApSAcK
C09248
KEGG COMPOUND
View more database links
Registry Numbers
Types
Sources
2632-29-3
CAS Registry Number
KEGG COMPOUND
2632-29-3
CAS Registry Number
ChemIDplus
772464
Beilstein Registry Number
Beilstein
772464
Reaxys Registry Number
Reaxys
Citations
Types
Sources
15195303
PubMed citation
Europe PMC
1895202
PubMed citation
Europe PMC
1982768
PubMed citation
Europe PMC
776609
PubMed citation
Europe PMC
9834903
PubMed citation
Europe PMC
Last Modified
02 February 2015