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(1alpha,4beta,5beta)-4-Hydroxy-7(11),10(14)-guaiadien-8-one

PropertiesImage
MNX_IDMNXM129955 Image of MNXM129955
referencechebi:168564
formulaC15H22O2
global charge0
mol weight234.339
InChIKeyITIGZFMSPAFZAE-UHFFFAOYSA-N
InChIInChI=1S/C15H22O2/c1-9(2)12-8-13-11(5-6-15(13,4)17)10(3)7-14(12)16/h11,13,17H,3,5-8H2,1-2,4H3
SMILESC=C1CC(=O)C(=C(C)C)CC2C1CCC2(C)O
MNX internals
InChI (mnx)InChI=1/C15H22O2/c1-9(2)12-8-13-11(5-6-15(13,4)17)10(3)7-14(12)16/h11,13,17H,3,5-8H2,1-2,4H3/t11?,13?,15? Image of MNXM129955
SMILES (mnx)[CH3:1][C:9]([CH3:2])=[C:12]1[CH2:8][CH:13]2[CH:11]([CH2:5][CH2:6][C:15]2([CH3:4])[OH:17])[C:10](=[CH2:3])[CH2:7][C:14]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:168564
chebi:168564
ITIGZFMSPAFZAE-UHFFFAOYSA-N 		(1alpha,4beta,5beta)-4-Hydroxy-7(11),10(14)-guaiadien-8-one
3-hydroxy-3-methyl-8-methylidene-5-propan-2-ylidene-2,3a,4,8a-tetrahydro-1H-azulen-6-one
hmdb:HMDB0036449
ITIGZFMSPAFZAE-UHFFFAOYSA-N 		(1alpha,4beta,5beta)-4-Hydroxy-7(11),10(14)-guaiadien-8-one
(1a,4b,5b)-4-Hydroxy-7(11),10(14)-guaiadien-8-one
(1alpha,4beta,5beta)-4-hydroxy-7(11),10(14)-guaiadien-8-one
1-hydroxy-1-methyl-4-methylidene-7-(propan-2-ylidene)-decahydroazulen-6-one
1-hydroxy-1-methyl-4-methylidene-7-(propan-2-ylidene)-hexahydroazulen-6-one

hmdb:HMDB36449 		secondary/obsolete/fantasy identifier