1-[2,3-di(hexadecanoyl)-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-5-iodanyl-pyrimidine-2,4-dione

Systemtic Name: 1-[2,3-di(hexadecanoyl)-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-5-iodanyl-pyrimidine-2,4-dione Openeye Name: 1-[2,3-di(hexadecanoyl)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-iodo-pyrimidine-2,4-dione CAS Name: 1-[4-hydroxy-5-(hydroxymethyl)-2,3-bis(1-oxohexadecyl)-2-oxolanyl]-5-iodopyrimidine-2,4-dione IUPAC Name: 1-[2,3-di(hexadecanoyl)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-iodopyrimidine-2,4-dione Traditional Name: 1-[2,3-di(hexadecanoyl)-4-hydroxy-5-methylol-tetrahydrofuran-2-yl]-5-iodo-pyrimidine-2,4-quinone Formula: C41H71IN2O7 MolecularWeight: 830.91611

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)C1C(C(OC1(C(=O)CCCCCCCCCCCCCCC)N2C=C(C(=O)NC2=O)I)CO)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)C1C(C(OC1(C(=O)CCCCCCCCCCCCCCC)N2C=C(C(=O)NC2=O)I)CO)O

InChI

InChI=1S/C41H71IN2O7/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-34(46)37-38(48)35(32-45)51-41(37,44-31-33(42)39(49)43-40(44)50)36(47)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h31,35,37-38,45,48H,3-30,32H2,1-2H3,(H,43,49,50)