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Substance Name: A-770041
RN: 869748-10-7
UNII: U9855G2ZPR
InChIKey: ZMNWFTYYYCSSTF-SOAUALDESA-N

Note

  • A Lck inhibitor used to prevent heart allograft rejection.

Molecular Formula

  • C34-H39-N9-O3

Molecular Weight

  • 621.7421
 
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Names and Synonyms

Name of Substance

  • A-770041

Synonyms

  • 1H-Indole-2-carboxamide, N-(4-(1-(trans-4-(4-acetyl-1-piperazinyl)cyclohexyl)-4-amino-1H-pyrazolo(3,4-d)pyrimidin-3-yl)-2-methoxyphenyl)-1-methyl-
  • A-770041
  • UNII-U9855G2ZPR

Registry Numbers

CAS Registry Number

  • 869748-10-7

FDA UNII

  • U9855G2ZPR

System Generated Number

  • 0869748107

Structure Descriptors

InChI

1S/C34H39N9O3/c1-21(44)41-14-16-42(17-15-41)24-9-11-25(12-10-24)43-33-30(32(35)36-20-37-33)31(39-43)23-8-13-26(29(19-23)46-3)38-34(45)28-18-22-6-4-5-7-27(22)40(28)2/h4-8,13,18-20,24-25H,9-12,14-17H2,1-3H3,(H,38,45)(H2,35,36,37)/t24-,25-

InChIKey

ZMNWFTYYYCSSTF-SOAUALDESA-N

Smiles

CC(=O)N1CCN(CC1)[C@H]2CC[C@@H](CC2)n3nc(c4c3ncnc4N)c5cc(c(cc5)NC(=O)c6n(c7c(c6)cccc7)C)OC