grayanotoxane
Molecular Formula:
C
20
H
34
InChI:
InChI=1/C20H34/c1-13-11-20-10-8-18-16(7-9-19(18,3)4)14(2)17(20)6-5-15(13)12-20/h13-18H,5-12H2,1-4H3/t13-,14+,15-,16-,17-,18-,20+/m0/s1
InChIKey:
InChIKey=OPCBUBFCCPXFES-GPDUBVANBI
SMILES:
CC1CC23CCC4C(CCC4(C)C)C(C2CCC1C3)C
Names:
CHEBI:36614
grayanotoxane
Registries:
PubChem CID 9548688
PubChem ID 14717994