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Substance Name: NSC 634597
RN: 104789-79-9
UNII: SBN41G8CTO
InChIKey: HUYWXTRCNXGJSG-UHFFFAOYSA-N

Molecular Formula

  • C60-H72-O6

Molecular Weight

  • 889.2228
 
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Names and Synonyms

Results Name

  • NSC 634597

Name of Substance

  • p-Isopropylcalix-6-arene

Synonyms

  • NSC 634597
  • UNII-SBN41G8CTO

Systematic Name

  • 5,11,17,23,29,35-Hexaisopropylheptacyclo(31.3.1.1(3,7).1(9,13).1(15,19).1(21,25).1(27,31))dotetraconta-1(37),3(42),4,6,9(41),10,12,15(40),16,18,21(39),22,24,27(38),28,30,33,35-octadecaene-37,38,39,40,41,42-hexol

Registry Numbers

CAS Registry Number

  • 104789-79-9

FDA UNII

  • SBN41G8CTO

System Generated Number

  • 0104789799

Structure Descriptors

InChI

1S/C60H72O6/c1-31(2)37-13-43-25-45-15-38(32(3)4)17-47(56(45)62)27-49-19-40(34(7)8)21-51(58(49)64)29-53-23-42(36(11)12)24-54(60(53)66)30-52-22-41(35(9)10)20-50(59(52)65)28-48-18-39(33(5)6)16-46(57(48)63)26-44(14-37)55(43)61/h13-24,31-36,61-66H,25-30H2,1-12H3

InChIKey

HUYWXTRCNXGJSG-UHFFFAOYSA-N

Smiles

CC(C)c1cc2c(c(c1)Cc3cc(cc(c3O)Cc4cc(cc(c4O)Cc5cc(cc(c5O)Cc6cc(cc(c6O)Cc7cc(cc(c7O)C2)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C)O