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(+)-Thujan-3-ol

PropertiesImage
MNX_IDMNXM144834 Image of MNXM144834
referencekeggC:C20261
formulaC10H18O
global charge0
mol weight154.253
InChIKeyDZVXRFMREAADPP-JXUBOQSCSA-N
InChIInChI=1S/C10H18O/c1-6(2)10-4-8(10)7(3)9(11)5-10/h6-9,11H,4-5H2,1-3H3/t7-,8+,9-,10-/m0/s1
SMILESCC(C)[C@@]12C[C@@H]1[C@H](C)[C@@H](O)C2
MNX internals
InChI (mnx)InChI=1/C10H18O/c1-6(2)10-4-8(10)7(3)9(11)5-10/h6-9,11H,4-5H2,1-3H3/t7-,8+,9-,10-/m0/s1 Image of MNXM144834
SMILES (mnx)[CH3:1][CH:6]([CH3:2])[C@@:10]12[CH2:4][C@@H:8]1[C@H:7]([CH3:3])[C@@H:9]([OH:11])[CH2:5]2
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

kegg.compound:C20261
keggC:C20261
DZVXRFMREAADPP-JXUBOQSCSA-N 		(+)-Thujan-3-ol
hmdb:HMDB0032530
DZVXRFMREAADPP-JXUBOQSCSA-N 		Thujyl alcohol
(+)-3-Thujanol
(+)-Isothujol
(1S,3S,4S,5R)-1-isopropyl-4-methylbicyclo[3.1.0]hexan-3-ol
(1S,3S,4S,5R)-4-methyl-1-(propan-2-yl)bicyclo[3.1.0]hexan-3-ol
3-Thujanol
4-Methyl-1-(1-methylethyl)bicyclo[3.1.0]hexan-3-ol
Isothujol

hmdb:HMDB32530
keggC:M_C20261 		secondary/obsolete/fantasy identifier