CHEBI:29652 - Neoabietal

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Neoabietal
ChEBI ID CHEBI:29652
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C20H30O
Net Charge 0
Average Mass 286.452
Monoisotopic Mass 286.22967
InChI InChI=1S/C20H30O/c1-14(2)15-6-8-17-16(12-15)7-9-18-19(3,13-21)10-5-11-20(17,18)4/h12-13,17-18H,5-11H2,1-4H3/t17-,18-,19-,20+/m0/s1
InChIKey JPCTZWFFRZZTMM-LWYYNNOASA-N
SMILES CC(C)=C1CC[C@H]2C(CC[C@H]3[C@@](C)(CCC[C@]23C)C=O)=C1
ChEBI Ontology
Outgoing Neoabietal (CHEBI:29652) is a diterpenoid (CHEBI:23849)
Synonyms Sources
Neoabietal KEGG COMPOUND
Neoabietinal KEGG COMPOUND
Manual Xref Database
C11885 KEGG COMPOUND
View more database links
Registry Number Type Source
19898-57-8 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014