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Substance Name: 16,16-Dimethyprostaglandin E2 4-benzaldehyde semicarbazone ester
RN: 62845-71-0
InChIKey: PKMLAURFVOXJGV-UCVYYBDESA-N

Molecular Formula

  • C30-H43-N3-O6

Molecular Weight

  • 541.6847
 
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Names and Synonyms

Name of Substance

  • 16,16-Dimethyprostaglandin E2 4-benzaldehyde semicarbazone ester

Synonyms

  • (5Z,11alpha,13E,15R)-4-(((Aminocarbonyl)hydrazono)methyl)phenyl 11,15-dihydroxy-16,16-dimethyl-9-oxoprosta-5,13-dien-oate
  • Dimethyl-PGE2-pbase

Systematic Name

  • Prosta-5,13-dien-oic acid, 11,15-dihydroxy-16,16-dimethyl-9-oxo-, 4-(((aminocarbonyl)hydrazono)methyl)phenyl ester, (5Z,11alpha,13E,15R)-

Registry Numbers

CAS Registry Number

  • 62845-71-0

System Generated Number

  • 0062845710

Structure Descriptors

InChI

1S/C30H43N3O6/c1-4-5-18-30(2,3)27(36)17-16-24-23(25(34)19-26(24)35)10-8-6-7-9-11-28(37)39-22-14-12-21(13-15-22)20-32-33-29(31)38/h6,8,12-17,20,23-24,26-27,35-36H,4-5,7,9-11,18-19H2,1-3H3,(H3,31,33,38)/b8-6-,17-16+,32-20+/t23-,24-,26-,27-/m1/s1

InChIKey

PKMLAURFVOXJGV-UCVYYBDESA-N

Smiles

CCCCC(C)(C)[C@@H](/C=C/[C@H]1[C@@H](CC(=O)[C@@H]1C/C=C\CCCC(=O)Oc2ccc(cc2)/C=N/NC(=O)N)O)O