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Substance Name: Celangulin II
RN: 144379-41-9
InChIKey: WSXXLLLVOJEZCC-DUHPUZQDSA-N

Note

  • Isolated from the root bark of Celastrus angulatus

Molecular Formula

  • C35-H42-O16

Molecular Weight

  • 718.7008
 
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Names and Synonyms

Results Name

  • Celangulin II

Synonym

  • Celangulin II

Systematic Names

  • 3-Furancarboxylic acid, (3R,4R,5R,5aS,6R,7S,9S,9aS,10R)-6,7,10-tris(acetyloxy)octahydro-9-hydroxy-2,2,9-trimethyl-5a-((2-methyl-1-oxopropoxy)methyl)-2H-3,9a-methano-1-benzoxepin-4,5-diyl ester
  • 3-Furancarboxylic acid, 6,7,10-tris(acetyloxy)octahydro-9-hydroxy-2,2,9-trimethyl-5a-((2-methyl-1-oxopropoxy)methyl)-2H-3,9a-methano-1-benzoxepin-4,5-diyl ester, (3R-(3alpha,4alpha,5beta,5aalpha,6alpha,7alpha,9beta,9aalpha,10R*))-

Registry Numbers

CAS Registry Number

  • 144379-41-9

System Generated Number

  • 0144379419

Structure Descriptors

InChI

1S/C35H42O16/c1-17(2)29(39)45-16-34-26(47-19(4)37)23(46-18(3)36)13-33(8,42)35(34)27(48-20(5)38)24(32(6,7)51-35)25(49-30(40)21-9-11-43-14-21)28(34)50-31(41)22-10-12-44-15-22/h9-12,14-15,17,23-28,42H,13,16H2,1-8H3/t23-,24+,25+,26-,27+,28-,33-,34-,35-/m0/s1

InChIKey

WSXXLLLVOJEZCC-DUHPUZQDSA-N