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Substance Name: Pepticinnamin E
RN: 147317-36-0
InChIKey: SGXHOALVNXPUDW-AZFZHSADSA-N

Note

  • Isolated from Streptomyces; inhibits farnesyl-protein transferase.

Molecular Weight

  • 908.444
 
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Names and Synonyms

Name of Substance

  • Pepticinnamin E

Synonym

  • Pepticinnamine E

Systematic Name

  • L-Phenylalanine, N-(2-chloro-3-hydroxy-N,O-dimethyl-N-(N-(1-oxo-3-(2-(1-pentenyl)phenyl)-2-propenyl)-D-tyrosyl)tyrosyl)-N-methyl-, (3,6-dioxo-2-piperazinyl)methyl ester, (R-(E,Z))-

Registry Numbers

CAS Registry Number

  • 147317-36-0

System Generated Number

  • 0147317360

Structure Descriptors

InChI

1S/C49H54ClN5O10/c1-5-6-8-15-33-16-11-12-17-34(33)21-25-41(57)53-37(26-31-18-22-36(56)23-19-31)45(60)49(28-32-13-9-7-10-14-32,48(63)65-30-39-46(61)52-29-42(58)54-39)55(3)47(62)38(51-2)27-35-20-24-40(64-4)44(59)43(35)50/h6-14,16-25,37-39,51,56,59H,5,15,26-30H2,1-4H3,(H,52,61)(H,53,57)(H,54,58)/b8-6+,25-21+/t37-,38+,39-,49-/m1/s1

InChIKey

SGXHOALVNXPUDW-AZFZHSADSA-N

Smiles

C([C@@](N(C)C([C@@H](NC)Cc1c(c(c(OC)cc1)O)Cl)=O)(Cc1ccccc1)C([C@H](NC(\C=C\c1c(cccc1)C\C=C\CC)=O)Cc1ccc(O)cc1)=O)(=O)OC[C@H]1NC(CNC1=O)=O