Chemical Compound

Pradimicin E

CAS Registry Number 127985-27-7
Pradimicin E chemical structure
Primary Record

Pradimicin E

In stock
2,970 g
Purity
99.8 %
CAS
127985-27-7

Compound Identifiers & Properties

CAS
127985-27-7
PubChem CID
456406
SMILES
C[C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O[C@@H]2[C@H](C3=CC4=C(C(=C3C5=C2C=C(C(=C5O)C(=O)NCC(=O)O)C)O)C(=O)C6=C(C4=O)C(=CC(=C6)OC)O)O)O)O[C@H]7[C@@H]([C@H]([C@@H](CO7)O)O)O)N
Canonical SMILES
COc1cc(O)c2c(c1)C(=O)c1c(cc3c(c1O)-c1c(cc(C)c(C(=O)NCC(=O)O)c1O)[C@H](O[C@@H]1O[C@H](C)[C@H](N)[C@H](O[C@@H]4OC[C@@H](O)[C@H](O)[C@H]4O)[C@H]1O)[C@H]3O)C2=O

Names & Synonyms

  • Pradimicin E
  • Des-N-methyl-pradimicin D
  • AC1L9UUU
  • RefChem:175693
  • SCHEMBL29711583
  • CHEBI:221604
  • HELMFNXPQUQJFY-FPDYCEOPSA-N
  • BU-3608E
  • CID456406
  • J2.958.396J
  • 127985-27-7
  • 2-[[(5S,6S)-5-[(2S,3R,4S,5S,6R)-5-amino-3-hydroxy-6-methyl-4-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-1,6,9,14-tetrahydroxy-11-methoxy-3-methyl-8,13-dioxo-5,6-dihydrobenzo[a]tetracene-2-carbonyl]amino]acetic acid
  • 2-(((5S,6S)-5-((2S,3R,4S,5S,6R)-5-amino-3-hydroxy-6-methyl-4-((2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl)oxy-1,6,9,14-tetrahydroxy-11-methoxy-3-methyl-8,13-dioxo-5,6-dihydrobenzo(a)tetracene-2-carbonyl)amino)acetic acid
  • 2-[[(5S,6S)-5-[(2S,3R,4S,5S,6R)-5-amino-3-hydroxy-6-methyl-4-[(2S,3R,4S,5R)-3,4,5-trihydroxytetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-1,6,9,14-tetrahydroxy-11-methoxy-3-methyl-8,13-dioxo-5,6-dihydrobenzo[a]tetracene-2-carbonyl]amino]acetic acid
  • 2-[[5-[5-amino-3-hydroxy-6-methyl-4-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxy-1,6,9,14-tetrahydroxy-11-methoxy-3-methyl-8,13-dioxo-5,6-dihydrobenzo[a]tetracene-2-carbonyl]amino]acetic acid
  • 2-{[(5S,6S)-5-{[(2S,3R,4S,5S,6R)-5-amino-3-hydroxy-6-methyl-4-{[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy}oxan-2-yl]oxy}-1,6,9,14-tetrahydroxy-11-methoxy-3-methyl-8,13-dioxo-5H,6H,8H,13H-naphtho[1,2-b]anthracen-2-yl]formamido}acetic acid
  • Glycine, N-[[(5S,6S)-5-[(4-amino-4,6-dideoxy-3-O-.beta.-D-xylopyranosyl-.beta.-D-galactopyranosyl)oxy]-5,6,8,13-tetrahydro-1,6,9,14-tetrahydroxy-11-methoxy-3-methyl-8,13-dioxobenzo[a]naphthacen-2-yl]carbonyl]-
  • N-[[[(5S)-5alpha-[(3-O-beta-D-Xylopyranosyl-4-amino-4,6-dideoxy-beta-D-galactopyranosyl)oxy]-5,6,8,13-tetrahydro-1,6beta,9,14-tetrahydroxy-11-methoxy-3-methyl-8,13-dioxobenzo[a]naphthacene]-2-yl]carbonyl]-D-glycine