(2R,4S)-2-[(2R,3R,6R)-3-[(2S)-2-amino-3-hydroxypropanamido]-6-[4-amino-5-(hydroxymethyl)-2-oxopyrimidin-1-yl]-3,6-dihydro-2H-pyran-2-yl]-5-carbamimidamido-2,4-dihydroxypentanoic acid

AlkaPlorer ID: AK325123

Synonym: None

IUPAC Name: None

Structure

SMILES: N=C(N)NC[C@@H](O)C[C@](O)(C(=O)O)[C@@H]1O[C@@H](N2C=C(CO)C(=N)N=C2O)C=C[C@H]1N=C(O)[C@@H](N)CO

copy

InChI: InChI=1S/C19H30N8O9/c20-10(7-29)15(31)25-11-1-2-12(27-5-8(6-28)14(21)26-18(27)34)36-13(11)19(35,16(32)33)3-9(30)4-24-17(22)23/h1-2,5,9-13,28-30,35H,3-4,6-7,20H2,(H,25,31)(H,32,33)(H2,21,26,34)(H4,22,23,24)/t9-,10-,11+,12+,13+,19+/m0/s1

copy

InChIKey: QKJJCZYFXJCKRX-GGOOVPPYSA-N

copy

Reference

SuperNatural Ⅲ: SN0307832-06

NPASS: NPC56165

Properties Information

Molecule Weight: 514.4960000000003

TPSA: 309.86

MolLogP: -4.291459999999993

Number of H-Donors: 12

Number of H-Acceptors: 13

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information