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Acorusnol

PropertiesImage
MNX_IDMNXM118808 Image of MNXM118808
referencechebi:168086
formulaC15H24O2
global charge0
mol weight236.355
InChIKeySZNXJUGSSOHWJM-ZOWXZIJZSA-N
InChIInChI=1S/C15H24O2/c1-9(2)11-7-8-15(4)12(16)6-5-10(3)13(15)14(11)17/h9,11-12,16H,5-8H2,1-4H3/t11-,12+,15-/m0/s1
SMILESCC1=C2C(=O)[C@H](C(C)C)CC[C@@]2(C)[C@H](O)CC1
MNX internals
InChI (mnx)InChI=1/C15H24O2/c1-9(2)11-7-8-15(4)12(16)6-5-10(3)13(15)14(11)17/h9,11-12,16H,5-8H2,1-4H3/t11-,12+,15-/m0/s1 Image of MNXM118808
SMILES (mnx)[CH3:1][CH:9]([CH3:2])[C@@H:11]1[CH2:7][CH2:8][C@@:15]2([CH3:4])[C@H:12]([OH:16])[CH2:6][CH2:5][C:10]([CH3:3])=[C:13]2[C:14]1=[O:17]
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:168086
chebi:168086
SZNXJUGSSOHWJM-ZOWXZIJZSA-N 		Acorusnol
(2S,4aR,5R)-5-hydroxy-4a,8-dimethyl-2-propan-2-yl-2,3,4,5,6,7-hexahydronaphthalen-1-one
hmdb:HMDB0030920
SZNXJUGSSOHWJM-UHFFFAOYSA-N 		Acorusnol
5-hydroxy-2-isopropyl-4a,8-dimethyl-2,3,4,5,6,7-hexahydronaphthalen-1-one
5-hydroxy-4a,8-dimethyl-2-(propan-2-yl)-1,2,3,4,4a,5,6,7-octahydronaphthalen-1-one

hmdb:HMDB30920 		secondary/obsolete/fantasy identifier