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(S)-beta-macrocarpene

PropertiesImage
MNX_IDMNXM4209 Image of MNXM4209
referencechebi:61344
formulaC15H24
global charge0
mol weight204.357
InChIKeyBKRLNEMLMVJATK-CYBMUJFWSA-N
InChIInChI=1S/C15H24/c1-12-6-8-13(9-7-12)14-5-4-10-15(2,3)11-14/h5-6,13H,4,7-11H2,1-3H3/t13-/m1/s1
SMILESCC1=CC[C@@H](C2=CCCC(C)(C)C2)CC1
MNX internals
InChI (mnx)InChI=1/C15H24/c1-12-6-8-13(9-7-12)14-5-4-10-15(2,3)11-14/h5-6,13H,4,7-11H2,1-3H3/t13-/m1/s1 Image of MNXM4209
SMILES (mnx)[CH3:1][C:12]1=[CH:6][CH2:8][C@@H:13]([C:14]2=[CH:5][CH2:4][CH2:10][C:15]([CH3:2])([CH3:3])[CH2:11]2)[CH2:9][CH2:7]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)10
in models (compartimentalized) 2
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:61344
chebi:61344
BKRLNEMLMVJATK-CYBMUJFWSA-N 		(S)-beta-macrocarpene
(-)-beta-macrocarpene
(1'S)-4',5,5-trimethyl-1,1'-bi(cyclohexane)-1,3'-diene

kegg.compound:C19752
keggC:C19752
BKRLNEMLMVJATK-CYBMUJFWSA-N 		(S)-beta-Macrocarpene
(1'S)-4',5,5-Trimethyl-1,1'-bi(cyclohexane)-1,3'-diene

seed.compound:cpd20998
seedM:cpd20998
BKRLNEMLMVJATK-CYBMUJFWSA-N 		(S)-beta-Macrocarpene
(S)-beta-macrocarpene

metacyc.compound:CPD-12759
metacycM:CPD-12759
BKRLNEMLMVJATK-CYBMUJFWSA-N 		(S)-beta-macrocarpene

keggC:M_C19752
seedM:M_cpd20998 		secondary/obsolete/fantasy identifier