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

Systemtic Name: 1-[5-(hydroxymethyl)-2,3-di(octanoyl)-4-oxidanyl-oxolan-2-yl]-5-iodanyl-pyrimidine-2,4-dione Openeye Name: 1-[4-hydroxy-5-(hydroxymethyl)-2,3-di(octanoyl)tetrahydrofuran-2-yl]-5-iodo-pyrimidine-2,4-dione CAS Name: 1-[4-hydroxy-5-(hydroxymethyl)-2,3-bis(1-oxooctyl)-2-oxolanyl]-5-iodopyrimidine-2,4-dione IUPAC Name: 1-[4-hydroxy-5-(hydroxymethyl)-2,3-di(octanoyl)oxolan-2-yl]-5-iodopyrimidine-2,4-dione Traditional Name: 1-(2,3-dicaprylyl-4-hydroxy-5-methylol-tetrahydrofuran-2-yl)-5-iodo-pyrimidine-2,4-quinone Formula: C25H39IN2O7 MolecularWeight: 606.49083

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)C1C(C(OC1(C(=O)CCCCCCC)N2C=C(C(=O)NC2=O)I)CO)O

Isomeric SMILES

CCCCCCCC(=O)C1C(C(OC1(C(=O)CCCCCCC)N2C=C(C(=O)NC2=O)I)CO)O

InChI

InChI=1S/C25H39IN2O7/c1-3-5-7-9-11-13-18(30)21-22(32)19(16-29)35-25(21,20(31)14-12-10-8-6-4-2)28-15-17(26)23(33)27-24(28)34/h15,19,21-22,29,32H,3-14,16H2,1-2H3,(H,27,33,34)