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Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks
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Tricyclohumuladiol
Properties
Image
Occurences in reactions
MNX_ID
MNXM145004
#reac
in my sandbox
0
in MNXref (generic)
0
in models (compartimentalized)
0
formula
C
15
H
26
O
2
charge
0
mass
238.19328
reference
hmdb:HMDB0036730
InChIKey
USFOCJBPTUMHRF-UHFFFAOYSA-N
InChI
InChI=1S/C15H26O2/c1-13(2)7-10-12(13)9-8-14(9,3)11(16)5-6-15(10,4)17/h9-12,16-17H,5-8H2,1-4H3
SMILES
CC1(C)CC2C1C1CC1(C)C(O)CCC2(C)O
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
Identifier
Description
hmdb:HMDB0036730
Tricyclohumuladiol
4,8,11,11-tetramethyltricyclo[7.2.0.0²,⁴]undecane-5,8-diol
hmdb:HMDB36730
secondary/obsolete/fantasy identifier