CHEBI:7849 - oxolucidine B

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ChEBI Name oxolucidine B
ChEBI ID CHEBI:7849
Definition An organonitrogen heterocyclic compound that is lucidine B in which the hydrogen at the 4a position of the dodecahydrobenzo[5,6]cyclohepta[1,2-b]pyridinyl moiety is substituted by a hydroxy group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C30H49N3O2
Net Charge 0
Average Mass 483.72908
Monoisotopic Mass 483.38248
InChI InChI=1S/C30H49N3O2/c1-18-11-22-15-29-30(35,23-16-26(22)27(12-18)32(4)17-23)8-7-24(31-29)14-21-10-19(2)13-28-25(21)6-5-9-33(28)20(3)34/h18-19,21-28,35H,5-17H2,1-4H3/t18-,19+,21-,22+,23-,24+,25+,26-,27+,28-,30+/m1/s1
InChIKey QRIZONDFXOOWTA-MREYPERPSA-N
SMILES [H][C@]1(CC[C@]2(O)[C@H]3CN(C)[C@H]4C[C@H](C)C[C@@]([H])(CC2=N1)[C@@]4([H])C3)C[C@@]1([H])C[C@H](C)C[C@@]2([H])N(CCC[C@@]12[H])C(C)=O
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted 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 oxolucidine B (CHEBI:7849) has functional parent lucidine B (CHEBI:6556)
oxolucidine B (CHEBI:7849) is a decahydroquinoline alkaloid (CHEBI:47009)
oxolucidine B (CHEBI:7849) is a organonitrogen heterocyclic compound (CHEBI:38101)
oxolucidine B (CHEBI:7849) is a tertiary alcohol (CHEBI:26878)
oxolucidine B (CHEBI:7849) is a tertiary amino compound (CHEBI:50996)
IUPAC Name
(1R,2S,5S,9S,11R,13S,17R)-5-{[(4aS,5R,7S,8aR)-1-acetyl-7-methyldecahydroquinolin-5-yl]methyl}-11,14-dimethyl-6,14-diazatetracyclo[7.6.2.02,7.013,17]heptadec-6-en-2-ol
Synonyms Sources
(4aS,5R,7S,8aR)-1-acetyl-5-[[(2S,4aS,5R,6aR,7S,9R,10aS)-3,4,4a,5,6,6a,7,8,9,10,10a,11-dodecahydro-4a-hydroxy-9,12-dimethyl-7,5-(iminomethano)-2H-benzo[5,6]cyclohepta[1,2-b]pyridin-2-yl]methyl]decahydro-7-methylquinoline IUPAC
Oxolucidine B KEGG COMPOUND
Serratanine B KEGG COMPOUND
Manual Xrefs Databases
C00001953 KNApSAcK
C09891 KEGG COMPOUND
View more database links
Registry Numbers Types Sources
71384-25-3 CAS Registry Number ChemIDplus
8600822 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
10731030 PubMed citation Europe PMC
15565253 PubMed citation Europe PMC
Last Modified
28 July 2014