**This is a beta version of MetaNetX/MNXref, MNXref identifiers may not be final**

ent-isokaurene

Properties Image MNX_ID MNXM2822 reference chebi:50783 formula C20H32 global charge 0 mol weight 272.476 InChIKey DQUHDYWUEKWRLN-HPUSYDDDSA-N InChI InChI=1S/C20H32/c1-14-12-20-11-8-16-18(2,3)9-5-10-19(16,4)17(20)7-6-15(14)13-20/h12,15-17H,5-11,13H2,1-4H3/t15-,16-,17+,19-,20-/m1/s1 SMILES CC1=C[C@@]23CC[C@@H]4C(C)(C)CCC[C@@]4(C)[C@@H]2CC[C@@H]1C3 MNX internals InChI (mnx) InChI=1/C20H32/c1-14-12-20-11-8-16-18(2,3)9-5-10-19(16,4)17(20)7-6-15(14)13-20/h12,15-17H,5-11,13H2,1-4H3/t15-,16-,17+,19-,20-/m1/s1 SMILES (mnx) [CH2:1]1[CH2:2][CH2:3][C:16]([CH3:18])([CH3:19])[C@@H:10]2[CH2:4][CH2:5][C@@:11]34[CH:8]=[C:12]([CH3:20])[C@H:13]([CH2:7][CH2:14][C@H:15]3[C@:6]12[CH3:17])[CH2:9]4

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 12 in models (compartimentalized) 2

Similar chemical compounds in external resources

Identifier	Description
CHEBI:50783 chebi:50783 DQUHDYWUEKWRLN-HPUSYDDDSA-N	ent-isokaurene (5beta,8alpha,9beta,10alpha,13alpha)-kaur-15-ene ent-kaur-15-ene
seed.compound:cpd21378 seedM:cpd21378 DQUHDYWUEKWRLN-HPUSYDDDSA-N	ent-Isokaurene (5beta,8alpha,9beta,10beta,13alpha)-kaur-15-ene Kaur-15-ene Kryptomeren ent-isokaurene ent-kaur-15-ene
kegg.compound:C20145 keggC:C20145 DQUHDYWUEKWRLN-HPUSYDDDSA-N	ent-Isokaurene Kaur-15-ene Kryptomeren
seed.compound:cpd28858 seedM:cpd28858	ent-isokaurene
metacyc.compound:CPD-11534 metacycM:CPD-11534 DQUHDYWUEKWRLN-HPUSYDDDSA-N	ent-isokaurene (5beta,8alpha,9beta,10beta,13alpha)-kaur-15-ene ent-kaur-15-ene
keggC:M_C20145 seedM:M_cpd21378 seedM:M_cpd28858	secondary/obsolete/fantasy identifier