TG(20:3(5Z,8Z,11Z)/20:0/20:3(5Z,8Z,11Z))
  Mrv1652304062000552D          

 70 69  0  0  0  0            999 V2000
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    9.5779   -8.1444    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8638   -8.5575    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1497   -8.1444    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.5457   -6.6225    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.5457   -5.8511    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   19.1175   -6.6225    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
> <DATABASE_ID>
FDB106824

> <DATABASE_NAME>
foodb

> <SMILES>
[H]C(COC(=O)CCC\C=C/C\C=C/C\C=C/CCCCCCCC)(COC(=O)CCC\C=C/C\C=C/C\C=C/CCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCCCC

> <INCHI_IDENTIFIER>
InChI=1S/C63H110O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-52-55-61(64)67-58-60(69-63(66)57-54-51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)59-68-62(65)56-53-50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h25-26,28-29,34-35,37-38,43-44,46-47,60H,4-24,27,30-33,36,39-42,45,48-59H2,1-3H3/b28-25-,29-26-,37-34-,38-35-,46-43-,47-44-

> <INCHI_KEY>
XHEAJMDJLPMZEK-CRDXHJEPSA-N

> <FORMULA>
C63H110O6

> <MOLECULAR_WEIGHT>
963.5439

> <EXACT_MASS>
962.830241252

> <JCHEM_ACCEPTOR_COUNT>
3

> <JCHEM_ATOM_COUNT>
179

> <JCHEM_AVERAGE_POLARIZABILITY>
127.09613683656978

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
3-[(5Z,8Z,11Z)-icosa-5,8,11-trienoyloxy]-2-(icosanoyloxy)propyl (5Z,8Z,11Z)-icosa-5,8,11-trienoate

> <ALOGPS_LOGP>
10.92

> <JCHEM_LOGP>
22.08744172433333

> <ALOGPS_LOGS>
-8.21

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA_STRONGEST_BASIC>
-6.56594718557974

> <JCHEM_POLAR_SURFACE_AREA>
78.9

> <JCHEM_REFRACTIVITY>
303.20189999999997

> <JCHEM_ROTATABLE_BOND_COUNT>
56

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
5.90e-06 g/l

> <JCHEM_TRADITIONAL_IUPAC>
3-[(5Z,8Z,11Z)-icosa-5,8,11-trienoyloxy]-2-(icosanoyloxy)propyl (5Z,8Z,11Z)-icosa-5,8,11-trienoate

> <JCHEM_VEBER_RULE>
0

> <FOODB_ID>
FDB106824

> <GENERIC_NAME>
TG(20:3(5Z,8Z,11Z)/20:0/20:3(5Z,8Z,11Z))

$$$$