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Substance Name: Canaliculatol
RN: 114488-83-4
InChIKey: UXHSAOFTHSNXMK-UHFFFAOYSA-N

Molecular Weight

  • 680.706
 
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Names and Synonyms

Results Name

  • Canaliculatol

Synonym

  • (-)-Canaliculatol

Systematic Name

  • Benz(7,8)indeno(2',1':4,5)cycloocta(1,2,3-cd)benzofuran-4,6,9,11,14-pentol, 2,2a,7,7a,12,12a-hexahydro-2,7,12-tris(4-hydroxyphenyl)-,(2R,2aR,7R,7aR,12R,12aS)-

Registry Numbers

CAS Registry Number

  • 114488-83-4

System Generated Number

  • 0114488834

Structure Descriptors

InChI

1S/C42H32O9/c43-22-7-1-19(2-8-22)34-36-28(13-25(46)16-31(36)49)39-35(20-3-9-23(44)10-4-20)37-29(14-26(47)17-32(37)50)41-38-30(40(34)39)15-27(48)18-33(38)51-42(41)21-5-11-24(45)12-6-21/h1-18,34-35,39-50H

InChIKey

UXHSAOFTHSNXMK-UHFFFAOYSA-N

Smiles

c1c(cc2[C@@H]3[C@@H](c4cc(cc5O[C@@H](c6ccc(cc6)O)[C@@H](c45)c4c(c(cc(c4)O)O)[C@@H]3c3ccc(cc3)O)O)[C@@H](c3ccc(cc3)O)c2c1O)O