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Details

Stereochemistry RACEMIC
Molecular Formula C40H80O2
Molecular Weight 593.062
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PENTACOSYL 12-METHYLTETRADECANOATE

SMILES

CCCCCCCCCCCCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCC(C)CC

InChI

InChIKey=NPEKVGVEGRLXRS-UHFFFAOYSA-N
InChI=1S/C40H80O2/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-26-29-32-35-38-42-40(41)37-34-31-28-25-24-27-30-33-36-39(3)5-2/h39H,4-38H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C40H80O2
Molecular Weight 593.062
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Record UNII
N5R15490XZ
Record Status Validated (UNII)
Record Version