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(+)-5-epi-aristolochene

Properties

Image

Occurences in reactions

MNX_ID

MNXM1365632

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

formula

C₁₅H₂₄

charge

mass

204.357

reference

InChIKey

YONHOSLUBQJXPR-UMVBOHGHSA-N

InChI

InChI=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

SMILES

[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

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:23925 chebi:23925	(+)-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	(+)-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
sabiork.compound:21141 sabiorkM:21141	5-Epiaristolochene
seed.compound:cpd20956 seedM:cpd20956	5-Epiaristolochene (+)-5-Epiaristolochene (+)-5-epi-Aristolochene (+)-5-epi-aristolochene 5-epi-Aristolochene 5-epiaristolochene
kegg.compound:C19708 keggC:C19708	5-Epiaristolochene (+)-5-Epiaristolochene (+)-5-epi-Aristolochene 5-epi-Aristolochene
keggC:M_C19708 seedM:M_cpd20956	secondary/obsolete/fantasy identifier