Chemical Compound

J927.429D

J927.429D chemical structure
Primary Record

J927.429D

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
101934353
SMILES
CC1=C2[C@H]3[C@H](C(=O)NC(=O)N3[C@H]4C[C@@H]([C@H](O4)CO)OP(=O)(OC[C@@H]5[C@H](C[C@@H](O5)N6C1N2C6=O)O)O)CS[C@@H]7[C@@H]8C9=C(C1N9C(=O)N1[C@H]1C[C@@H]([C@H](O1)COP(=O)(O[C@H]1C[C@H](N8C(=O)NC7=O)O[C@@H]1CO)O)O)C
Canonical SMILES
CC1=C2[C@H]3[C@@H](CS[C@H]4C(=O)NC(=O)N5[C@H]6C[C@H](OP(=O)(O)OC[C@H]7O[C@H](C[C@@H]7O)N7C(=O)N8C(=C(C)C87)[C@@H]45)[C@@H](CO)O6)C(=O)NC(=O)N3[C@H]3C[C@H](OP(=O)(O)OC[C@H]4O[C@H](C[C@@H]4O)N4C(=O)N2C14)[C@@H](CO)O3

Names & Synonyms

  • J927.429D
  • (1R,8R,9R,14R,16R,17S,22R,23S)-9-({[(1R,8S,9R,14R,16R,17S,22R,23S)-19,23-dihydroxy-16-(hydroxymethyl)-6-methyl-3,10,12,19-tetraoxo-15,18,20,25-tetraoxa-2,4,11,13-tetraaza-19lambda5-phosphahexacyclo[20.2.1.114,17.02,5.04,7.08,13]hexacos-6-en-9-yl]sulfanyl}methyl)-19,23-dihydroxy-16-(hydroxymethyl)-6-methyl-15,18,20,25-tetraoxa-2,4,11,13-tetraaza-19lambda5-phosphahexacyclo[20.2.1.114,17.02,5.04,7.08,13]hexacos-6-ene-3,10,12,19-tetrone
  • (5R)-5alpha-[[(5R)-6alpha,3 -O-[(3-Methyl-6-oxo-1,5-diazabicyclo[2.2.0]hex-2-ene-2,5-diyl)[[(2R)-4alpha-hydroxytetrahydrofuran]-2beta,5beta-diyl]methyleneoxyphosphinico]-5,6-dihydro-2 -deoxyuridin]-5alpha-ylmethylthio]-6alpha,1-[(3-methyl-6-oxo-1,5-diazabicyclo[2.2.0]hex-2-ene-2,5-diyl)[[(2R)-4alpha-hydroxytetrahydrofuran]-2beta,5beta-diyl]methyleneoxyphosphinicooxy[[(2R)-5beta-(hydroxymethyl)tetrahydrofuran]-4alpha,2beta-diyl]]-5,6-dihydropyrimidine-2,4(1H,3H)-dione