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Zedoarondiol

PropertiesImage
MNX_IDMNXM145485 Image of MNXM145485
referencechebi:138763
formulaC15H24O3
global charge0
mol weight252.354
InChIKeyTXIKNNOOLCGADE-PAPYEOQZSA-N
InChIInChI=1S/C15H24O3/c1-9(2)10-7-12-11(5-6-14(12,3)17)15(4,18)8-13(10)16/h11-12,17-18H,5-8H2,1-4H3/t11-,12+,14+,15-/m1/s1
SMILESCC(C)=C1C[C@H]2[C@@H](CC[C@]2(C)O)[C@](C)(O)CC1=O
MNX internals
InChI (mnx)InChI=1/C15H24O3/c1-9(2)10-7-12-11(5-6-14(12,3)17)15(4,18)8-13(10)16/h11-12,17-18H,5-8H2,1-4H3/t11-,12+,14+,15-/m1/s1 Image of MNXM145485
SMILES (mnx)[CH3:1][C:9]([CH3:2])=[C:10]1[CH2:7][C@H:12]2[C@@H:11]([CH2:5][CH2:6][C@:14]2([CH3:3])[OH:17])[C@:15]([CH3:4])([OH:18])[CH2:8][C:13]1=[O:16]
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:138763
chebi:138763
TXIKNNOOLCGADE-PAPYEOQZSA-N 		Zedoarondiol

CHEBI:183414
chebi:183414
TXIKNNOOLCGADE-UHFFFAOYSA-N 		1,4-dihydroxy-1,4-dimethyl-7-(propan-2-ylidene)-decahydroazulen-6-one
3,8-dihydroxy-3,8-dimethyl-5-propan-2-ylidene-1,2,3a,4,7,8a-hexahydroazulen-6-one
hmdb:HMDB0036448
TXIKNNOOLCGADE-UHFFFAOYSA-N 		Zedoarondiol
1,4-dihydroxy-1,4-dimethyl-7-(propan-2-ylidene)-decahydroazulen-6-one
1,4-dihydroxy-1,4-dimethyl-7-(propan-2-ylidene)-hexahydroazulen-6-one

hmdb:HMDB36448 		secondary/obsolete/fantasy identifier