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Substance Name: Disodium (2R-(2R*(4R*,8R*)))-3,4-dihydro-2,8-dimethyl-2-(4,8,12-trimethyltridecyl)-2H-1-benzopyran-6-yl phosphate
RN: 100208-45-5
InChIKey: MYDOUYVRSVNHGL-WZTCXVHJSA-L

Molecular Formula

  • C27-H47-O5-P.2Na

Molecular Weight

  • 526.6015
 
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Names and Synonyms

Synonym

  • EINECS 309-247-1

Systematic Name

  • Disodium (2R-(2R*(4R*,8R*)))-3,4-dihydro-2,8-dimethyl-2-(4,8,12-trimethyltridecyl)-2H-1-benzopyran-6-yl phosphate

Registry Numbers

CAS Registry Number

  • 100208-45-5

System Generated Number

  • 0100208455

Molecular Formulas

Molecular Formula

  • C27-H47-O5-P.2Na

Molecular Formula Fragments

  • C27-H47-O5-P
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C27H47O5P.2Na/c1-20(2)10-7-11-21(3)12-8-13-22(4)14-9-16-27(6)17-15-24-19-25(32-33(28,29)30)18-23(5)26(24)31-27;;/h18-22H,7-17H2,1-6H3,(H2,28,29,30);;/q;2*+1/p-2/t21-,22-,27-;;/m1../s1

InChIKey

MYDOUYVRSVNHGL-WZTCXVHJSA-L

Smiles

Cc1cc(cc2c1O[C@](CC2)(C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)OP(=O)([O-])[O-].[Na+].[Na+]