CHEBI:15716 - 12-hydroxydihydrochelirubine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
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
Supplier Information
Download Molfile XML SDF
Formula C21H17NO6
Net Charge 0
Average Mass 379.36282
Monoisotopic Mass 379.106
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-2H,10H-[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