Chemical Compound

SCHEMBL13470054

SCHEMBL13470054 chemical structure
Primary Record

SCHEMBL13470054

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
89096373
SMILES
C1=CC(=CC(=C1)O[C@H]2C(C([C@@H](C(O2)CO)O[C@H]3C(C([C@H](C(O3)CO)O)O)O)O)O)C4=C5C=CC(=C(C6=NC(=C(C7=CC=C(N7)C(=C8C=CC4=N8)C9=CC(=CC=C9)O[C@H]1C(C([C@@H](C(O1)CO)O[C@H]1C(C([C@H](C(O1)CO)O)O)O)O)O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C(C6O)O)C1=CC(=CC=C1)O[C@H]1C(C([C@@H](C(O1)CO)O[C@H]1C(C([C@H](C(O1)CO)O)O)O)O)O)N5
Canonical SMILES
OCC1O[C@@H](O[C@@H]2C(CO)O[C@@H](Oc3cccc(-c4c5nc(c(-c6cccc(O[C@@H]7OC(CO)[C@@H](O[C@@H]8OC(CO)[C@H](O)C(O)C8O)C(O)C7O)c6)c6ccc([nH]6)c(-c6cc(C(F)(F)F)cc(C(F)(F)F)c6)c6nc(c(-c7cccc(O[C@@H]8OC(CO)[C@@H](O[C@@H]9OC(CO)[C@H](O)C(O)C9O)C(O)C8O)c7)c7ccc4[nH]7)C(O)C6O)C=C5)c3)C(O)C2O)C(O)C(O)[C@H]1O

Names & Synonyms

  • SCHEMBL13470054
  • YQKNNUQYILDHHZ-VLVRTRRQSA-N
  • (2S,5R)-2-[(3S,6S)-6-[3-[15-[3,5-bis(trifluoromethyl)phenyl]-10,20-bis[3-[(2S,5S)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,5R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxyphenyl]-12,13-dihydroxy-12,13,22,24-tetrahydroporphyrin-5-yl]phenoxy]-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol