Chemical Compound

4a-Hydroxy-fad

CAS Registry Number 96622-00-3
4a-Hydroxy-fad chemical structure
Primary Record

4a-Hydroxy-fad

In stock
618 g
Purity
99.5 %
CAS
96622-00-3

Compound Identifiers & Properties

CAS
96622-00-3
PubChem CID
126004
SMILES
CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3(N2)O)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H](C(O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O
Canonical SMILES
Cc1cc2c(cc1C)N(C[C@H](O)[C@H](O)[C@H](O)COP(=O)(O)OP(=O)(O)OC[C@H]1OC(n3cnc4c(N)ncnc43)[C@H](O)[C@@H]1O)C1=NC(=O)NC(=O)C1(O)N2

Names & Synonyms

  • 4a-Hydroxy-fad
  • AC1L2PKZ
  • RefChem:100603
  • KST-1A0043
  • AR-1A8135
  • CID126004
  • 96622-00-3
  • [[(2R,3S,4S)-5-(4a-hydroxy-7,8-dimethyl-2,4-dioxo-5H-benzo[g]pteridin-10-yl)-2,3,4-trihydroxypentoxy]-hydroxyphosphoryl] [(2R,3S,4R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl hydrogen phosphate
  • [(2r,3s,4r)-5-(6-amino-9h-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl(2r,3s,4s)-2,3,4-trihydroxy-5-(4a-hydroxy-7,8-dimethyl-2,4-dioxo-3,4,4a,5-tetrahydrobenzo[g]pteridin-10(2h)-yl)pentyl dihydrogen diphosphate(non-preferred name)
  • 3405-12-7