CHEBI:5278 - Garryine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Garryine
ChEBI ID CHEBI:5278
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C22H33NO2
Net Charge 0
Average Mass 343.504
Monoisotopic Mass 343.25113
InChI InChI=1S/C22H33NO2/c1-14-15-4-5-17-21(12-15,18(14)24)9-6-16-20(2)7-3-8-22(16,17)13-23-10-11-25-19(20)23/h15-19,24H,1,3-13H2,2H3/t15?,16-,17-,18+,19?,20-,21-,22+/m1/s1
InChIKey IVNWJNHFVISYHC-RXJQFMQKSA-N
SMILES C[C@]12CCC[C@@]3(CN4CCOC14)[C@@H]1CC[C@H]4C[C@@]1(CC[C@H]23)[C@@H](O)C4=C
ChEBI Ontology
Outgoing Garryine (CHEBI:5278) is a kaurane diterpenoid (CHEBI:53666)
Synonym Source
Garryine KEGG COMPOUND
Manual Xrefs Databases
C00001641 KNApSAcK
C08685 KEGG COMPOUND
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Registry Number Type Source
561-51-3 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014