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Substance Name: Lissoclinamide 7
RN: 126297-39-0
InChIKey: RBBBWKUBQVARPL-SWQMWMPHSA-N

Note

  • Cytotoxic peptide from Ascidian Lissoclinum patella.

Molecular Formula

  • C38-H45-N7-O5-S2

Molecular Weight

  • 743.9495
 
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Names and Synonyms

Name of Substance

  • Lissoclinamide 7

Synonyms

  • (3xi,7xi,14xi,21xi)-14-Dimethyl-7-de(1-methylpropyl)-10,11,17,18-tetrahydro-7-(1-methylethyl)-14-(phenylmethyl)ulicyclamide
  • Lissoclimamide

Systematic Name

  • Ulicyclamide, 7-de(1-methylpropyl)-10,11,17,18-tetrahydro-7-(1-methylethyl)-36-phenyl-, (3xi,7xi,14xi,21xi)-

Registry Numbers

CAS Registry Number

  • 126297-39-0

System Generated Number

  • 0126297390

Structure Descriptors

InChI

1S/C38H45N7O5S2/c1-21(2)30-37-42-28(20-52-37)32(46)39-25(17-23-11-6-4-7-12-23)36-41-27(19-51-36)33(47)40-26(18-24-13-8-5-9-14-24)38(49)45-16-10-15-29(45)35-44-31(22(3)50-35)34(48)43-30/h4-9,11-14,21-22,25-31H,10,15-20H2,1-3H3,(H,39,46)(H,40,47)(H,43,48)/t22-,25-,26+,27+,28+,29+,30-,31+/m1/s1

InChIKey

RBBBWKUBQVARPL-SWQMWMPHSA-N

Smiles

C[C@@H]1[C@H]2C(=O)N[C@@H](C3=N[C@@H](CS3)C(=O)N[C@@H](C4=N[C@@H](CS4)C(=O)N[C@H](C(=O)N5CCC[C@H]5C(=N2)O1)Cc6ccccc6)Cc7ccccc7)C(C)C