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ent-isokaurene

Properties

Image

Occurences in reactions

MNX_ID

MNXM1372907

	#reac
in my sandbox	0
in MNXref (generic)	13
in models (compartimentalized)	2

formula

C₂₀H₃₂

charge

mass

272.476

reference

chebi:50783

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

[CH3:1][C:14]1=[CH:12][C@@:20]23[CH2:11][CH2:8][C@@H:16]4[C:18]([CH3:2])([CH3:3])[CH2:9][CH2:5][CH2:10][C@@:19]4([CH3:4])[C@@H:17]2[CH2:7][CH2:6][C@@H:15]1[CH2:13]3

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:50783 chebi:50783	ent-isokaurene (5beta,8alpha,9beta,10alpha,13alpha)-kaur-15-ene ent-kaur-15-ene
CHEBI:144262 chebi:144262	Isokaurane
seed.compound:cpd21378 seedM:cpd21378	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	ent-Isokaurene Kaur-15-ene Kryptomeren
metacyc.compound:CPD-11534 metacycM:CPD-11534	ent-isokaurene (5beta,8alpha,9beta,10beta,13alpha)-kaur-15-ene ent-kaur-15-ene
keggC:M_C20145 seedM:M_cpd21378	secondary/obsolete/fantasy identifier