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Substance Name: Patellamide E
RN: 140430-46-2
InChIKey: BEMLSIBAHWVXGD-UHFFFAOYSA-N

Note

  • From Lissoclinum patella.

Molecular Formula

  • C39-H50-N8-O6-S2

Molecular Weight

  • 791.006
 
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Names and Synonyms

Name of Substance

  • Patellamide E

Systematic Name

  • Ulithiacyclamide, 1,15-de(dithiobis(methylene))-8,22-dide(2-methylpropyl)-1,8-bis(1-methylethyl)-15-(1-methylpropyl)-22-(phenylmethyl)-, (1S,15S)-

Registry Numbers

CAS Registry Number

  • 140430-46-2

System Generated Number

  • 0140430462

Structure Descriptors

InChI

1S/C39H50N8O6S2/c1-9-20(6)29-37-47-30(21(7)53-37)34(50)40-24(15-23-13-11-10-12-14-23)38-41-25(16-54-38)32(48)43-27(18(2)3)36-46-31(22(8)52-36)35(51)44-28(19(4)5)39-42-26(17-55-39)33(49)45-29/h10-14,16-22,24,27-31H,9,15H2,1-8H3,(H,40,50)(H,43,48)(H,44,51)(H,45,49)

InChIKey

BEMLSIBAHWVXGD-UHFFFAOYSA-N

Smiles

CCC(C)C1C2=NC(C(O2)C)C(=O)NC(c3nc(cs3)C(=O)NC(C4=NC(C(O4)C)C(=O)NC(c5nc(cs5)C(=O)N1)C(C)C)C(C)C)Cc6ccccc6