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Substance Name: Kelletinin I
RN: 87697-99-2
InChIKey: UFYXGHSICNSXJL-HNRBIFIRSA-N

Note

  • From marine mollusc Buccinulum corneum.

Molecular Weight

  • 602.545
 
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Names and Synonyms

Name of Substance

  • Kelletinin I

Synonym

  • Erythrityl tetrakis (4-hydroxybenzoate)

Systematic Name

  • Benzoic acid, 4-hydroxy-, 1,2,3,4-butanetetrayl ester, (R*,S*)-

Registry Numbers

CAS Registry Number

  • 87697-99-2

System Generated Number

  • 0087697992

Structure Descriptors

InChI

1S/C32H26O12/c33-23-9-1-19(2-10-23)29(37)41-17-27(43-31(39)21-5-13-25(35)14-6-21)28(44-32(40)22-7-15-26(36)16-8-22)18-42-30(38)20-3-11-24(34)12-4-20/h1-16,27-28,33-36H,17-18H2/t27-,28+

InChIKey

UFYXGHSICNSXJL-HNRBIFIRSA-N

Smiles

C(O[C@H]([C@H](OC(c1ccc(cc1)O)=O)COC(c1ccc(cc1)O)=O)COC(c1ccc(cc1)O)=O)(c1ccc(cc1)O)=O