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Substance Name: Onalespib lactate [USAN]
RN: 1019889-35-0
UNII: 66226JUH2I
InChIKey: VYRWEWHOAMGLLW-WNQIDUERSA-N

Classification Code

  • Treatment of Cancer

Molecular Formula

  • C24-H31-N3-O3.C3-H6-O3

Molecular Weight

  • 499.6043
 
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Names and Synonyms

Name of Substance

  • Onalespib lactate [USAN]

Synonyms

  • AT-13387 lactate
  • ATI-13387A
  • ATI-13387AU
  • Onalespib lactate
  • Onalespib lactate [USAN]
  • Propanoic acid, 2-hydroxy-, (2S)-, compd. with (1,3-dihydro-5-((4-methyl-1-piperazinyl)methyl)-2H-isoindol-2-yl)(2,4-dihydroxy-5-(1-methylethyl)phenyl)methanone (1:1)
  • UNII-66226JUH2I

Registry Numbers

CAS Registry Number

  • 1019889-35-0

FDA UNII

  • 66226JUH2I

System Generated Number

  • 1019889350

Structure Descriptors

InChI

1S/C24H31N3O3.C3H6O3/c1-16(2)20-11-21(23(29)12-22(20)28)24(30)27-14-18-5-4-17(10-19(18)15-27)13-26-8-6-25(3)7-9-26;1-2(4)3(5)6/h4-5,10-12,16,28-29H,6-9,13-15H2,1-3H3;2,4H,1H3,(H,5,6)/t;2-/m.0/s1

InChIKey

VYRWEWHOAMGLLW-WNQIDUERSA-N

Smiles

C[C@@H](C(=O)O)O.CC(C)c1cc(c(cc1O)O)C(=O)N2Cc3ccc(cc3C2)CN4CCN(CC4)C