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CHEBI:3999 - Cyclobuxine D

ChEBI IDCHEBI:3999
ChEBI NameCyclobuxine D
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC25H42N2O
Net Charge0
Average Mass386.624
Monoisotopic Mass386.32971
SMILES[H][C@]1([C@H](C)NC)[C@H](O)C[C@@]2(C)[C@]3([H])CC[C@@]4([H])C(=C)[C@@H](NC)CC[C@@]45C[C@@]35CC[C@]12C
InChIInChI=1S/C25H42N2O/c1-15-17-7-8-20-23(4)13-19(28)21(16(2)26-5)22(23,3)11-12-25(20)14-24(17,25)10-9-18(15)27-6/h16-21,26-28H,1,7-14H2,2-6H3/t16-,17-,18-,19+,20-,21-,22+,23-,24+,25-/m0/s1
InChIKeyBSNZFQANPMIOIU-WZBMPAQFSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
Cyclobuxine D (CHEBI:3999) is a steroid alkaloid (CHEBI:26767)
Synonyms  Source
Cyclobuxine DKEGG COMPOUND
CyclobuxineKEGG COMPOUND
Manual XrefsDatabases
C10797KEGG COMPOUND
C00002244KNApSAcK
Registry NumbersSources
CAS:2241-90-9KEGG COMPOUND