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(-)-alismoxide

PropertiesImage
MNX_IDMNXM100878 Image of MNXM100878
referencechebi:69844
formulaC15H26O2
global charge0
mol weight238.371
InChIKeyIWQURBSTAIRNAE-LJISPDSOSA-N
InChIInChI=1S/C15H26O2/c1-10(2)11-5-7-14(3,16)12-6-8-15(4,17)13(12)9-11/h9-10,12-13,16-17H,5-8H2,1-4H3/t12-,13+,14-,15+/m0/s1
SMILESCC(C)C1=C[C@@H]2[C@H](CC[C@@]2(C)O)[C@@](C)(O)CC1
MNX internals
InChI (mnx)InChI=1/C15H26O2/c1-10(2)11-5-7-14(3,16)12-6-8-15(4,17)13(12)9-11/h9-10,12-13,16-17H,5-8H2,1-4H3/t12-,13+,14-,15+/m0/s1 Image of MNXM100878
SMILES (mnx)[CH3:1][CH:10]([CH3:2])[C:11]1=[CH:9][C@@H:13]2[C@H:12]([CH2:6][CH2:8][C@@:15]2([CH3:4])[OH:17])[C@@:14]([CH3:3])([OH:16])[CH2:7][CH2:5]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:69844
chebi:69844
IWQURBSTAIRNAE-LJISPDSOSA-N
(-)-alismoxide
(1R,3aS,4S,8aR)-1,4-dimethyl-7-propan-2-yl-2,3,3a,5,6,8a-hexahydroazulene-1,4-diol
Guaianediol