CHEBI:36505 - labdane

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name labdane
ChEBI ID CHEBI:36505
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
more structures >>
Formula C20H38
Net Charge 0
Average Mass 278.524
Monoisotopic Mass 278.29735
InChI InChI=1S/C20H38/c1-7-15(2)9-11-17-16(3)10-12-18-19(4,5)13-8-14-20(17,18)6/h15-18H,7-14H2,1-6H3/t15-,16+,17+,18+,20-/m1/s1
InChIKey LEWJAHURGICVRE-AISVETHESA-N
SMILES C1CC[C@@]2([C@@H](CC[C@@H](CC)C)[C@H](CC[C@@]2([H])C1(C)C)C)C
ChEBI Ontology
Outgoing labdane (CHEBI:36505) is a diterpene (CHEBI:35190)
labdane (CHEBI:36505) is a terpenoid fundamental parent (CHEBI:35662)
Incoming (12E)-labda-8(17),12,14-triene (CHEBI:138302) has parent hydride labdane (CHEBI:36505)
(Z)-biformene (CHEBI:64282) has parent hydride labdane (CHEBI:36505)
syn-labda-8(17),12E,14-triene (CHEBI:63707) has parent hydride labdane (CHEBI:36505)
labda-7,13(16),14-triene (CHEBI:138301) has parent hydride labdane (CHEBI:36505)
labdane diterpenoid (CHEBI:36770) has parent hydride labdane (CHEBI:36505)
peregrinol (CHEBI:145550) has parent hydride labdane (CHEBI:36505)
sclarene (CHEBI:64281) has parent hydride labdane (CHEBI:36505)
IUPAC Name
labdane
Registry Number Type Source
6774712 Beilstein Registry Number Beilstein
Last Modified
03 December 2019