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Substance Name: 1-Hydroxy-24,24-dimethyl-22-dehydrovitamin D3
RN: 104211-64-5
InChIKey: NIKMORRDAXLLOU-YXJZIJINSA-N

Molecular Weight

  • 426.68
 
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Names and Synonyms

Name of Substance

  • 1-Hydroxy-24,24-dimethyl-22-dehydrovitamin D3

Synonym

  • OH-Dmdh-D3

Registry Numbers

CAS Registry Number

  • 104211-64-5

System Generated Number

  • 0104211645

Structure Descriptors

InChI

1S/C29H46O2/c1-19(2)28(5,6)16-14-20(3)25-12-13-26-22(9-8-15-29(25,26)7)10-11-23-17-24(30)18-27(31)21(23)4/h10-11,14,16,19-20,24-27,30-31H,4,8-9,12-13,15,17-18H2,1-3,5-7H3/b16-14+,22-10+,23-11-/t20-,24+,25-,26+,27-,29-/m1/s1

InChIKey

NIKMORRDAXLLOU-YXJZIJINSA-N

Smiles

C1[C@H](C\C(=C\C=C2\[C@@H]3CC[C@@H]([C@@H](\C=C\C(C)(C(C)C)C)C)[C@@]3(C)CCC2)C([C@@H]1O)=C)O