Chemical Compound

Validamycin C

CAS Registry Number 12650-70-3
Validamycin C chemical structure
Primary Record

Validamycin C

In stock
1,914 g
Purity
99.5 %
CAS
12650-70-3

Compound Identifiers & Properties

CAS
12650-70-3
PubChem CID
102403907
SMILES
C1[C@@H]([C@H]([C@@H]([C@H]([C@H]1N[C@H]2C=C([C@H]([C@@H]([C@H]2O)O)O)CO[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)CO
Canonical SMILES
OC[C@H]1C[C@H](N[C@H]2C=C(CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O

Names & Synonyms

  • Validamycin C
  • C26H45NO18
  • C26-H45-N-O18
  • BRN 4835203
  • J2.440.853A
  • (2R,3R,4S,5S,6R)-2-{[(3S,4S,5S,6R)-3-{[(1S,2S,3R,4R,5R)-2,3-dihydroxy-5-(hydroxymethyl)-4-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}cyclohexyl]amino}-4,5,6-trihydroxycyclohex-1-en-1-yl]methoxy}-6-(hydroxymethyl)oxane-3,4,5-triol
  • 12650-70-3
  • 4-O-(beta-D-Glucopyranosyl)-1-[[(1S,4R,5S,6S)-3-[(beta-D-glucopyranosyloxy)methyl]-4,5,6-trihydroxy-2-cyclohexene-1-yl]amino]-5-(hydroxymethyl)-1,5,6-trideoxy-D-chiro-inositol