CHEBI:52487 - dehydroabietadienal

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name dehydroabietadienal
ChEBI ID CHEBI:52487
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Kristian Axelsen
Supplier Information
Download Molfile XML SDF
Formula C20H28O
Net Charge 0
Average Mass 284.43570
Monoisotopic Mass 284.21402
InChI InChI=1S/C20H28O/c1-14(2)15-6-8-17-16(12-15)7-9-18-19(3,13-21)10-5-11-20(17,18)4/h6,8,12-14,18H,5,7,9-11H2,1-4H3/t18-,19-,20+/m0/s1
InChIKey YCLCHPWRGSDZKL-SLFFLAALSA-N
SMILES [H]C(=O)[C@]1(C)CCC[C@]2(C)c3ccc(cc3CC[C@@]12[H])C(C)C
ChEBI Ontology
Outgoing dehydroabietadienal (CHEBI:52487) is a abietane diterpenoid (CHEBI:36762)
dehydroabietadienal (CHEBI:52487) is a carbotricyclic compound (CHEBI:38032)
IUPAC Name
abieta-8,11,13-trien-18-al
Synonyms Sources
dehydroabietadienal UniProt
Dehydroabietal NIST Chemistry WebBook
Dehydroabietic aldehyde NIST Chemistry WebBook
Dehydroabietinal NIST Chemistry WebBook
Registry Numbers Types Sources
13601-88-2 CAS Registry Number NIST Chemistry WebBook
2218584 Beilstein Registry Number Beilstein
Last Modified
13 November 2017