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Substance Name: Nummularine B
RN: 53947-96-9
InChIKey: ZAVCUVYFGQXSRX-SQFISAMPSA-N

Molecular Formula

  • C32-H41-N5-O6

Molecular Weight

  • 591.7049
 
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Names and Synonyms

Results Name

  • Nummularine B

Synonyms

  • Daechuine S27
  • N-Demethylamphibine H
  • Nummularine B

Systematic Name

  • Propanamide, 2-(methylamino)-N-(2-methyl-1-((3,3a,12,13,14,15,16,16a-octahydro-8-methoxy-13,16-dioxo-14-(phenylmethyl)-5,9-metheno-9H-pyrrolo(3,2-b)(1,5,8)oxadiazacyclopentadecin-1(2H)-yl)carbonyl)propyl)-

Registry Numbers

CAS Registry Number

  • 53947-96-9

System Generated Number

  • 0053947969

Structure Descriptors

InChI

1S/C32H41N5O6/c1-19(2)27(36-29(38)20(3)33-4)32(41)37-16-14-26-28(37)31(40)35-24(17-21-9-7-6-8-10-21)30(39)34-15-13-22-18-23(43-26)11-12-25(22)42-5/h6-13,15,18-20,24,26-28,33H,14,16-17H2,1-5H3,(H,34,39)(H,35,40)(H,36,38)/b15-13-

InChIKey

ZAVCUVYFGQXSRX-SQFISAMPSA-N

Smiles

CC(C)C(C(=O)N1CCC2C1C(=O)NC(C(=O)N/C=C\c3cc(ccc3OC)O2)Cc4ccccc4)NC(=O)C(C)NC