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casbene

MNXM1103460 is deprecated and here replaced by MNXM1363846
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1363846 Image of MNXM1363846
referencechebi:17695
formulaC20H32
global charge0
mol weight272.476
InChIKeyZJMVJDFTNPZVMB-QOCMWZQCSA-N
InChIInChI=1S/C20H32/c1-15-8-6-10-16(2)12-13-18-19(20(18,4)5)14-17(3)11-7-9-15/h9-10,14,18-19H,6-8,11-13H2,1-5H3/b15-9+,16-10+,17-14+
SMILESC/C1=C\CC/C(C)=C/C2C(CC/C(C)=C/CC1)C2(C)C
MNX internals
InChI (mnx)InChI=1/C20H32/c1-15-8-6-10-16(2)12-13-18-19(20(18,4)5)14-17(3)11-7-9-15/h9-10,14,18-19H,6-8,11-13H2,1-5H3/b15-9+,16-10+,17-14+/t18?,19? Image of MNXM1363846
SMILES (mnx)[CH3:1]/[C:15]1=[CH:9]\[CH2:7][CH2:11]/[C:17]([CH3:3])=[CH:14]/[CH:19]2[CH:18]([CH2:13][CH2:12]/[C:16]([CH3:2])=[CH:10]/[CH2:6][CH2:8]1)[C:20]2([CH3:4])[CH3:5]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:17695
chebi:17695
ZJMVJDFTNPZVMB-QOCMWZQCSA-N 		casbene
(2E,6E,10E)-3,7,11,15,15-pentamethylbicyclo[12.1.0]pentadeca-2,6,10-triene
Casbene

kegg.compound:C01414
keggC:C01414
ZJMVJDFTNPZVMB-QOCMWZQCSA-N 		Casbene

seed.compound:cpd01013
seedM:cpd01013
ZJMVJDFTNPZVMB-QOCMWZQCSA-N 		Casbene
casbene

metacyc.compound:CPD-684
metacycM:CPD-684
ZJMVJDFTNPZVMB-QOCMWZQCSA-N 		casbene

chebi:13949
chebi:23049
chebi:3444
keggC:M_C01414
seedM:M_cpd01013 		secondary/obsolete/fantasy identifier