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beta-acoradiene

PropertiesImage
MNX_IDMNXM22501 Image of MNXM22501
referencemetacycM:CPD-8240
formulaC15H24
global charge0
mol weight204.357
InChIKeyDVBSKQAFCDJNSL-WLYUNCDWSA-N
InChIInChI=1S/C15H24/c1-11(2)14-6-5-13(4)15(14)9-7-12(3)8-10-15/h7,13-14H,1,5-6,8-10H2,2-4H3/t13-,14?,15?/m1/s1
SMILESC=C(C)C1CC[C@@H](C)C12CC=C(C)CC2
MNX internals
InChI (mnx)InChI=1/C15H24/c1-11(2)14-6-5-13(4)15(14)9-7-12(3)8-10-15/h7,13-14H,1,5-6,8-10H2,2-4H3/t13-,14?,15?/m1/s1 Image of MNXM22501
SMILES (mnx)[CH2:1]=[C:11]([CH3:2])[CH:14]1[CH2:6][CH2:5][C@@H:13]([CH3:4])[C:15]12[CH2:9][CH:7]=[C:12]([CH3:3])[CH2:8][CH2:10]2
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

metacyc.compound:CPD-8240
metacycM:CPD-8240
seed.compound:cpd25108
seedM:cpd25108
DVBSKQAFCDJNSL-WLYUNCDWSA-N
beta-acoradiene

seedM:M_cpd25108
secondary/obsolete/fantasy identifier