CHEBI:30232 - abieta-7,13-diene

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name abieta-7,13-diene
ChEBI ID CHEBI:30232
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:10771, CHEBI:29508
Supplier Information
Download Molfile XML SDF
Formula C20H32
Net Charge 0
Average Mass 272.46808
Monoisotopic Mass 272.25040
InChI InChI=1S/C20H32/c1-14(2)15-7-9-17-16(13-15)8-10-18-19(3,4)11-6-12-20(17,18)5/h8,13-14,17-18H,6-7,9-12H2,1-5H3/t17-,18-,20+/m0/s1
InChIKey BBPXZLJCPUPNGH-CMKODMSKSA-N
SMILES [H][C@]12CCC(=CC1=CC[C@@]1([H])C(C)(C)CCC[C@]21C)C(C)C
ChEBI Ontology
Outgoing abieta-7,13-diene (CHEBI:30232) is a abietadiene (CHEBI:50072)
Incoming abieta-7,13-dien-18,18-diol (CHEBI:63668) has parent hydride abieta-7,13-diene (CHEBI:30232)
abietal (CHEBI:29509) has parent hydride abieta-7,13-diene (CHEBI:30232)
abietol (CHEBI:29510) has parent hydride abieta-7,13-diene (CHEBI:30232)
IUPAC Name
abieta-7,13-diene
Synonyms Sources
(-)-Abietadiene KEGG COMPOUND
(4aS,4bR,10aS)-7-isopropyl-1,1,4a-trimethyl-1,2,3,4,4a,4b,5,6,10,10a-decahydrophenanthrene ChEBI
abieta-7,13-diene UniProt
Abietadiene KEGG COMPOUND
Abietadiene KEGG COMPOUND
Manual Xrefs Databases
C00000868 KNApSAcK
C11878 KEGG COMPOUND
LMPR0104050002 LIPID MAPS
View more database links
Registry Numbers Types Sources
2504776 Beilstein Registry Number Beilstein
35241-40-8 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014