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Substance Name: Sennidin B
RN: 517-44-2
UNII: VI631S52AW
InChIKey: JPMRHWLJLNKRTJ-SZPZYZBQSA-N

Molecular Formula

  • C30-H18-O10

Molecular Weight

  • 538.4622
 
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Names and Synonyms

Results Name

  • Sennidin B

Name of Substance

  • Sennidin B

Synonyms

  • EINECS 208-239-4
  • NSC 658576
  • Sennidin B
  • UNII-VI631S52AW

Systematic Names

  • (9,9'-Bianthracene)-2,2'-dicarboxylic acid, 9,9',10,10'-tetrahydro-4,4',5,5'-tetrahydroxy-10,10'-dioxo-, (R*,S*)-
  • (R*,S*)-9,9',10,10'-Tetrahydro-4,4',5,5'-tetrahydroxy-10,10'-dioxo(9,9'-bianthracene)-2,2'-dicarboxylic acid

Registry Numbers

CAS Registry Number

  • 517-44-2

FDA UNII

  • VI631S52AW

System Generated Number

  • 0000517442

Structure Descriptors

InChI

1S/C30H18O10/c31-17-5-1-3-13-21(15-7-11(29(37)38)9-19(33)25(15)27(35)23(13)17)22-14-4-2-6-18(32)24(14)28(36)26-16(22)8-12(30(39)40)10-20(26)34/h1-10,21-22,31-34H,(H,37,38)(H,39,40)/t21-,22+

InChIKey

JPMRHWLJLNKRTJ-SZPZYZBQSA-N

Smiles

OC(=O)c1cc(O)c2C(=O)c3c(O)cccc3[C@H]([C@@H]4c5cccc(O)c5C(=O)c6c(O)cc(cc46)C(=O)O)c2c1