L-Tyrosine, (3S)-3-hydroxy-N-(2-hydroxy-4-methyl-1-oxopentyl)-L-leucyl-L-phenylalanyl-, cyclic (13→3)-ether

CAS Registry Number®

181485-19-8

CAS Name

L-Tyrosine, (3S)-3-hydroxy-N-(2-hydroxy-4-methyl-1-oxopentyl)-L-leucyl-L-phenylalanyl-, cyclic (13→3)-ether

Molecular Formula

C30H39N3O7

Molecular Mass

553.65

Cite this Page

L-Tyrosine, (3S)-3-hydroxy-N-(2-hydroxy-4-methyl-1-oxopentyl)-L-leucyl-L-phenylalanyl-, cyclic (13→3)-ether.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=181485-19-8 (retrieved 2024-11-22) (CAS RN: 181485-19-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C30H39N3O7/c1-17(2)14-24(34)28(36)33-25-26(18(3)4)40-21-12-10-20(11-13-21)16-23(30(38)39)32-27(35)22(31-29(25)37)15-19-8-6-5-7-9-19/h5-13,17-18,22-26,34H,14-16H2,1-4H3,(H,31,37)(H,32,35)(H,33,36)(H,38,39)/t22-,23-,24?,25-,26-/m0/s1

InChIKey

InChIKey=OEJLUFSEWIDXDN-HJWJFLBDSA-N

SMILES

N(C(C(CC(C)C)O)=O)[C@H]1[C@H]([C@H](C)C)OC=2C=CC(=CC2)C[C@@H](C(O)=O)NC(=O)[C@H](CC3=CC=CC=C3)NC1=O

Canonical SMILES

O=C(O)C1NC(=O)C(NC(=O)C(NC(=O)C(O)CC(C)C)C(OC2=CC=C(C=C2)C1)C(C)C)CC=3C=CC=CC3

Other Names for this Substance

  • L-Tyrosine, (3S)-3-hydroxy-N-(2-hydroxy-4-methyl-1-oxopentyl)-L-leucyl-L-phenylalanyl-, cyclic (13→3)-ether
  • L-Tyrosine, erythro-3-hydroxy-N-(2-hydroxy-4-methyl-1-oxopentyl)-L-leucyl-L-phenylalanyl-, cyclic (13→3)-ether
  • Vignatic acid A

Deleted or Replaced CAS Registry Numbers

191546-93-7

CAS INSIGHTSTM
Targeted protein degrader structure, illustration