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> Main
CHEBI:15716 - 12-hydroxydihydrochelirubine
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ChEBI Name
12-hydroxydihydrochelirubine
ChEBI ID
CHEBI:15716
Definition
A benzophenanthridine alkaloid comprising dihydrochelirubine carrying a hydroxy substituent at the 12-position.
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:11317, CHEBI:741, CHEBI:19139
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Formula
C21H17NO6
Net Charge
0
Average Mass
379.36282
Monoisotopic Mass
379.10559
InChI
InChI=1S/C21H17NO6/c1-
22-
7-
13-
19(17(24-
2)
6-
18-
21(13)
28-
9-
27-
18)
12-
3-
14(23)
10-
4-
15-
16(26-
8-
25-
15)
5-
11(10)
20(12)
22/h3-
6,23H,7-
9H2,1-
2H3
InChIKey
LEHAJESKGINQOW-UHFFFAOYSA-N
SMILES
COc1cc2OCOc2c2CN(C)c3c(cc(O)c4cc5OCOc5cc34)-c12
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.
(via
alkaloid
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
12-hydroxydihydrochelirubine (
CHEBI:15716
)
has functional parent
chelirubine (
CHEBI:17031
)
12-hydroxydihydrochelirubine (
CHEBI:15716
)
is a
benzophenanthridine alkaloid (
CHEBI:38517
)
IUPAC Name
5-
methoxy-
13-
methyl-
13,14-
dihydro-
2
H
,10
H
-
[1,3]dioxolo[4,5-
i
][1,3]dioxolo[4',5':4,5]benzo[1,2-
c
]phenanthridin-
7-
ol
Synonyms
Sources
12-Hydroxychelirubine
KEGG COMPOUND
12-Hydroxydihydrochelirubine
KEGG COMPOUND
12-hydroxydihydrochelirubine
UniProt
Manual Xrefs
Databases
C00027673
KNApSAcK
C05193
KEGG COMPOUND
View more database links
Registry Number
Type
Source
131984-77-5
CAS Registry Number
KEGG COMPOUND
Last Modified
07 October 2015