MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks
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compound 0124052
Properties
Image
Occurences in reactions
MNX_ID
MNXM1197689
#reac
in my sandbox
0
in MNXref (generic)
0
in models (compartimentalized)
0
formula
C
54
H
96
O
11
charge
0
mass
920.69526
reference
envipathM:...15e2151e218f
InChIKey
OMYJSKWVZOIUSM-UHFFFAOYSA-N
InChI
InChI=1S/C54H96O11/c1-4-7-10-12-13-14-15-16-17-18-19-20-25-33-40-50(58)62-43(41-60-48(56)38-31-26-21-23-29-36-45-52(63-45)44(55)34-28-11-8-5-2)42-61-49(57)39-32-27-22-24-30-37-47-54(65-47)51(59)53-46(64-53)35-9-6-3/h15-16,43-47,51-55,59H,4-14,17-42H2,1-3H3
SMILES
CCCCCCCC=CCCCCCCCC(=O)OC(COC(=O)CCCCCCCC1OC1C(O)CCCCCC)COC(=O)CCCCCCCC1OC1C(O)C1OC1CCCC
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
Identifier
Description
envipath:...15e2151e218f
envipathM:...15e2151e218f
compound 0124052