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Substance Name: 24,25,28-Trihydroxyvitamin D2
RN: 123992-86-9
InChIKey: PQSMSWCTTXTLTE-AYTIQPORSA-N

Molecular Formula

  • C28-H44-O4

Molecular Weight

  • 444.6516
 
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Names and Synonyms

Name of Substance

  • 24,25,28-Trihydroxyvitamin D2

Synonym

  • 24,25,28-(OH)3-Vitamin D2

Systematic Name

  • 9,10-Secoergosta-5,7,10(19),22-tetraene-3,24,25,28-tetrol, (3beta,5Z,7E,22E,24xi)-

Registry Numbers

CAS Registry Number

  • 123992-86-9

System Generated Number

  • 0123992869

Structure Descriptors

InChI

1S/C28H44O4/c1-19-8-11-23(30)17-22(19)10-9-21-7-6-15-27(5)24(12-13-25(21)27)20(2)14-16-28(32,18-29)26(3,4)31/h9-10,14,16,20,23-25,29-32H,1,6-8,11-13,15,17-18H2,2-5H3/b16-14+,21-9+,22-10-/t20-,23+,24-,25+,27-,28?/m1/s1

InChIKey

PQSMSWCTTXTLTE-AYTIQPORSA-N

Smiles

C[C@H](/C=C/C(CO)(C(C)(C)O)O)[C@H]1CC[C@@H]\2[C@@]1(CCC/C2=C\C=C/3\C[C@H](CCC3=C)O)C