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(+)-endo-beta-bergamotene

PropertiesImage
MNX_IDMNXM4142 Image of MNXM4142
referencechebi:61678
formulaC15H24
global charge0
mol weight204.357
InChIKeyDGZBGCMPRYFWFF-KKUMJFAQSA-N
InChIInChI=1S/C15H24/c1-11(2)6-5-9-15(4)13-8-7-12(3)14(15)10-13/h6,13-14H,3,5,7-10H2,1-2,4H3/t13-,14-,15-/m0/s1
SMILESC=C1CC[C@H]2C[C@@H]1[C@@]2(C)CCC=C(C)C
MNX internals
InChI (mnx)InChI=1/C15H24/c1-11(2)6-5-9-15(4)13-8-7-12(3)14(15)10-13/h6,13-14H,3,5,7-10H2,1-2,4H3/t13-,14-,15-/m0/s1 Image of MNXM4142
SMILES (mnx)[CH3:1][C:11]([CH3:2])=[CH:6][CH2:5][CH2:9][C@@:15]1([CH3:4])[C@H:13]2[CH2:8][CH2:7][C:12](=[CH2:3])[C@@H:14]1[CH2:10]2
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:61678
chebi:61678
DGZBGCMPRYFWFF-KKUMJFAQSA-N 		(+)-endo-beta-bergamotene
(1S,5S,6S)-6-methyl-2-methylidene-6-(4-methylpent-3-en-1-yl)bicyclo[3.1.1]heptane

kegg.compound:C19737
keggC:C19737
DGZBGCMPRYFWFF-KKUMJFAQSA-N 		(+)-endo-beta-Bergamotene

seed.compound:cpd20984
seedM:cpd20984
DGZBGCMPRYFWFF-KKUMJFAQSA-N 		(+)-endo-beta-Bergamotene
(+)-cis-beta-bergamotene
(+)-endo-beta-bergamotene

metacyc.compound:CPD-11287
metacycM:CPD-11287
DGZBGCMPRYFWFF-KKUMJFAQSA-N 		(+)-endo-beta-bergamotene
(+)-cis-beta-bergamotene

keggC:M_C19737
seedM:M_cpd20984 		secondary/obsolete/fantasy identifier