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ent-kaur-16-ene

PropertiesImage
MNX_IDMNXM1188 Image of MNXM1188
referencechebi:15415
formulaC20H32
global charge0
mol weight272.476
InChIKeyONVABDHFQKWOSV-HPUSYDDDSA-N
InChIInChI=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/h15-17H,1,5-13H2,2-4H3/t15-,16-,17+,19-,20-/m1/s1
SMILESC=C1C[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/h15-17H,1,5-13H2,2-4H3/t15-,16-,17+,19-,20-/m1/s1 Image of MNXM1188
SMILES (mnx)[CH2:1]=[C:14]1[CH2:12][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
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)22
in models (compartimentalized) 4
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:15415
chebi:15415
ONVABDHFQKWOSV-HPUSYDDDSA-N 		ent-kaur-16-ene
(5beta,8alpha,9beta,10alpha,13alpha)-kaur-16-ene
ent-Kaur-16-ene
ent-Kaurene
ent-kaurene
hmdb:HMDB0035394
ONVABDHFQKWOSV-HPUSYDDDSA-N 		ent-16-Kaurene
(-)-Kaur-16-ene
(-)-Kaurene
16-Kaurene
5,5,9-trimethyl-14-methylidenetetracyclo[11.2.1.0^{1,10}.0^{4,9}]hexadecane
Kauren-16-ene
Kaurene
a-Podocarpene
a-Podocarprene

sabiork.compound:8387
sabiorkM:8387
kegg.compound:C06090
keggC:C06090
ONVABDHFQKWOSV-HPUSYDDDSA-N
ONVABDHFQKWOSV-ZJXASSBSSA-N 		ent-Kaurene
ent-Kaur-16-ene

seed.compound:cpd03630
seedM:cpd03630
ONVABDHFQKWOSV-HPUSYDDDSA-N 		ent-Kaurene
ent-Kaur-16-ene
ent-kaur-16-ene
ent-kaurene

lipidmaps:LMPR0104130002
lipidmapsM:LMPR0104130002
ONVABDHFQKWOSV-HPUSYDDDSA-N 		ent-kaurene
(5beta,8alpha,9beta,10alpha,13alpha)-kaur-16-ene
ent-Kaur-16-ene
ent-Kaurene
ent-kaur-16-ene

metacyc.compound:CPD1F-128
metacycM:CPD1F-128
ONVABDHFQKWOSV-HPUSYDDDSA-N 		ent-kaurene
ent-kaur-16-ene

hmdb:HMDB35394
chebi:10551
chebi:10788
chebi:12817
chebi:23920
keggC:M_C06090
seedM:M_cpd03630 		secondary/obsolete/fantasy identifier