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Substance Name: DS-3801A
RN: 1369412-66-7
UNII: 5H2DV04I6O
InChIKey: XCVUPJBVKKACQB-KJOQGJGQSA-N

Molecular Formula

  • C28-H39-N3-O3

Molecular Weight

  • 465.6276
 
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Names and Synonyms

Name of Substance

  • DS-3801A

Synonyms

  • Cyclohexanecarboxamide, 4-(3-(hydroxymethyl)phenoxy)-N-methyl-N-(3-methyl-4-(((3S)-3-methyl-1-piperazinyl)methyl)phenyl)-, trans-
  • DS-3801A
  • DS-3801B free base
  • UNII-5H2DV04I6O

Registry Numbers

CAS Registry Number

  • 1369412-66-7

FDA UNII

  • 5H2DV04I6O

System Generated Number

  • 1369412667

Structure Descriptors

InChI

1S/C28H39N3O3/c1-20-15-25(10-7-24(20)18-31-14-13-29-21(2)17-31)30(3)28(33)23-8-11-26(12-9-23)34-27-6-4-5-22(16-27)19-32/h4-7,10,15-16,21,23,26,29,32H,8-9,11-14,17-19H2,1-3H3/t21-,23-,26-/m0/s1

InChIKey

XCVUPJBVKKACQB-KJOQGJGQSA-N

Smiles

C[C@H]1CN(Cc2ccc(cc2C)N(C)C(=O)[C@@H]3CC[C@H](CC3)Oc4cccc(CO)c4)CCN1