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(+)-5-epi-aristolochene

MNXM1956 is deprecated and here replaced by MNXM1108021
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1108021 Image of MNXM1108021
referencechebi:23925
formulaC15H24
global charge0
mol weight204.357
InChIKeyYONHOSLUBQJXPR-UMVBOHGHSA-N
InChIInChI=1S/C15H24/c1-11(2)13-8-9-14-7-5-6-12(3)15(14,4)10-13/h9,12-13H,1,5-8,10H2,2-4H3/t12-,13-,15-/m1/s1
SMILESC=C(C)[C@@H]1CC=C2CCC[C@@H](C)[C@@]2(C)C1
MNX internals
InChI (mnx)InChI=1/C15H24/c1-11(2)13-8-9-14-7-5-6-12(3)15(14,4)10-13/h9,12-13H,1,5-8,10H2,2-4H3/t12-,13-,15-/m1/s1 Image of MNXM1108021
SMILES (mnx)[CH2:1]=[C:11]([CH3:2])[C@@H:13]1[CH2:8][CH:9]=[C:14]2[CH2:7][CH2:5][CH2:6][C@@H:12]([CH3:3])[C@@:15]2([CH3:4])[CH2:10]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)15
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:23925
chebi:23925
YONHOSLUBQJXPR-UMVBOHGHSA-N 		(+)-5-epi-aristolochene
(4R,4aR,6R)-4,4a-dimethyl-6-(prop-1-en-2-yl)-1,2,3,4,4a,5,6,7-octahydronaphthalene
4betaH-eremophila-9,11-diene
epi-aristolochene

lipidmaps:LMPR0103270004
lipidmapsM:LMPR0103270004
YONHOSLUBQJXPR-UMVBOHGHSA-N 		(+)-5-epi-aristolochene
(4R,4aR,6R)-4,4a-dimethyl-6-(prop-1-en-2-yl)-1,2,3,4,4a,5,6,7-octahydronaphthalene 4betaH-eremophila-9,11-diene
epi-aristolochene

metacyc.compound:CPD-4664
metacycM:CPD-4664
YONHOSLUBQJXPR-UMVBOHGHSA-N 		(+)-5-epi-aristolochene
5-epiaristolochene

sabiork.compound:21141
sabiorkM:21141
YONHOSLUBQJXPR-UMVBOHGHSA-N 		5-Epiaristolochene

seed.compound:cpd20956
seedM:cpd20956
YONHOSLUBQJXPR-UMVBOHGHSA-N 		5-Epiaristolochene
(+)-5-Epiaristolochene
(+)-5-epi-Aristolochene
(+)-5-epi-aristolochene
5-epi-Aristolochene
5-epiaristolochene

kegg.compound:C19708
keggC:C19708
YONHOSLUBQJXPR-UMVBOHGHSA-N 		5-Epiaristolochene
(+)-5-Epiaristolochene
(+)-5-epi-Aristolochene
5-epi-Aristolochene

keggC:M_C19708
seedM:M_cpd20956 		secondary/obsolete/fantasy identifier