CHEBI:52026 - amorpha-4,11-diene

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name amorpha-4,11-diene
ChEBI ID CHEBI:52026
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Kristian Axelsen
Supplier Information
Download Molfile XML SDF
Formula C15H24
Net Charge 0
Average Mass 204.35110
Monoisotopic Mass 204.188
InChI InChI=1S/C15H24/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h9,12-15H,1,5-8H2,2-4H3/t12-,13+,14+,15-/m1/s1
InChIKey HMTAHNDPLDKYJT-CBBWQLFWSA-N
SMILES [H][C@@]12CCC(C)=C[C@]1([H])[C@@H](CC[C@H]2C)C(C)=C
ChEBI Ontology
Outgoing amorpha-4,11-diene (CHEBI:52026) is a octahydronaphthalenes (CHEBI:138397)
amorpha-4,11-diene (CHEBI:52026) is a sesquiterpene (CHEBI:35189)
IUPAC Name
(1R,4R,4aS,8aR)-4,7-dimethyl-1-(prop-1-en-2-yl)-1,2,3,4,4a,5,6,8a-octahydronaphthalene
Synonym Source
(+)-amorpha-4,11-diene UniProt
Database Links Databases
C00017520 KNApSAcK
C16028 KEGG COMPOUND
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Registry Number Type Source
6966730 Beilstein Registry Number Beilstein
Last Modified
07 September 2017