MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks
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The Swiss Initiative in Systems Biology
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labd-13-en-8alpha-,15 diol
Properties
Image
Occurences in reactions
MNX_ID
MNXM18977
#reac
in my sandbox
0
in MNXref (generic)
2
in models (compartimentalized)
0
formula
C
20
H
38
O
2
charge
0
mass
310.28718
reference
metacycM:CPD-12746
InChIKey
MCHQEVJMCLOQAZ-YXAMPDCWSA-N
InChI
InChI=1S/C20H38O2/c1-15(10-14-21)7-8-17-19(4)12-6-11-18(2,3)16(19)9-13-20(17,5)22/h15-17,21-22H,6-14H2,1-5H3/t15?,16?,17?,19-,20+/m0/s1
SMILES
CC(CCO)CCC1[C@@]2(C)CCCC(C)(C)C2CC[C@@]1(C)O
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
Identifier
Description
metacyc.compound:CPD-12746
metacycM:CPD-12746
seed.compound:cpd23559
seedM:cpd23559
labd-13-en-8alpha-,15 diol
seedM:M_cpd23559
secondary/obsolete/fantasy identifier