CHEBI:5770 - huperzine b

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name huperzine b
ChEBI ID CHEBI:5770
Stars This entity has been manually annotated by a third party.
Secondary ChEBI IDs CHEBI:43181
Supplier Information
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Formulae C16H20N2O
C16H20N2O
Net Charge 0
Average Mass 256.34288
Monoisotopic Mass 256.15756
InChI InChI=1S/C16H20N2O/c1-10-7-11-8-14-13(4-5-15(19)18-14)16(9-10)12(11)3-2-6-17-16/h4-5,7,11-12,17H,2-3,6,8-9H2,1H3,(H,18,19)/t11-,12+,16+/m0/s1
InChIKey YYWGABLTRMRUIT-HWWQOWPSSA-N
SMILES [C@@]123[C@@]([C@@H](C=C(C1)C)CC4=C2C=CC(N4)=O)(CCCN3)[H]
Roles Classification
Biological Role(s): xenobiotic
A xenobiotic (Greek, xenos "foreign"; bios "life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means.
(via phenanthrenes )
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ChEBI Ontology
Outgoing huperzine b (CHEBI:5770) is a phenanthrol (CHEBI:25962)
Synonyms Sources
(4aR,5R,10bR)-12-methyl-2,3,4,4a,5,6-hexahydro-1H-5,10b-prop[1]eno-1,7-phenanthrolin-8(7H)-one PDBeChem
HUPERZINE B PDBeChem
Huperzine B KEGG COMPOUND
Manual Xrefs Databases
C00001939 KNApSAcK
C09866 KEGG COMPOUND
HUB PDBeChem
View more database links
Registry Number Type Source
103548-82-9 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014