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Substance Name: Aphidicolin glycinate
RN: 92803-82-2
InChIKey: SGPJMFVJKNVPLI-CJXLBUIWSA-N

Note

  • DNA polymerase II inhibitor.

Molecular Formula

  • C22-H37-N-O5.Cl-H

Molecular Weight

  • 431.997
 
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Names and Synonyms

Name of Substance

  • Aphidicolin glycinate

Synonyms

  • Aphidicolin-17-glycinate
  • AphiG
  • NSC 303812

Systematic Name

  • Glycine, (tetradecahydro-3,9-dihydroxy-4-(hydroxymethyl)-4,11b-dimethyl-8,11a-methano-11aH-cyclohepta(a)naphthalen-9-yl)methyl ester, hydrochloride, (3R-(3alpha,4alpha,4aalpha,6abeta,8beta,9beta,11abeta,11bbeta))-

Registry Numbers

CAS Registry Number

  • 92803-82-2

System Generated Number

  • 0092803822

Molecular Formulas

Molecular Formula

  • C22-H37-N-O5.Cl-H

Molecular Formula Fragments

  • C22-H37-N-O5
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C22H37NO5.ClH/c1-19(12-24)16-4-3-14-9-15-10-21(14,20(16,2)6-5-17(19)25)7-8-22(15,27)13-28-18(26)11-23;/h14-17,24-25,27H,3-13,23H2,1-2H3;1H/t14-,15+,16-,17+,19-,20-,21-,22-;/m0./s1

InChIKey

SGPJMFVJKNVPLI-CJXLBUIWSA-N

Smiles

C1[C@@H]2[C@@]3(CC[C@]([C@@H](C2)C3)(O)COC(CN)=O)[C@@]2(CC[C@H]([C@@]([C@H]2C1)(CO)C)O)C.Cl