Asukamycin

CAS Registry Number®

61116-33-4

CAS Name

Asukamycin

Molecular Formula

C31H34N2O7

Molecular Mass

546.61

Cite this Page

Asukamycin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=61116-33-4 (retrieved 2024-11-21) (CAS RN: 61116-33-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C31H34N2O7/c34-23-17-18-24(35)27(23)33-26(37)16-10-3-4-11-19-31(39)20-22(28(38)29-30(31)40-29)32-25(36)15-9-2-1-6-12-21-13-7-5-8-14-21/h1-4,6,9-12,15-16,19-21,29-30,34,39H,5,7-8,13-14,17-18H2,(H,32,36)(H,33,37)/b2-1+,4-3+,12-6+,15-9+,16-10+,19-11+/t29-,30-,31+/m1/s1

InChIKey

InChIKey=SSHVAUUEPNULMP-JHWDTTIQSA-N

SMILES

C(=C/C=C/C=C/C(NC=1C(=O)CCC1O)=O)\[C@@]2(O)[C@]3([C@](O3)(C(=O)C(NC(/C=C/C=C/C=C/C4CCCCC4)=O)=C2)[H])[H]

Canonical SMILES

O=C(C=CC=CC=CC1CCCCC1)NC2=CC(O)(C=CC=CC=CC(=O)NC=3C(=O)CCC3O)C4OC4C2=O

Other Names for this Substance

  • 2,4,6-Heptatrienamide, 7-cyclohexyl-N-[(1S,5S,6R)-5-hydroxy-5-[(1E,3E,5E)-7-[(2-hydroxy-5-oxo-1-cyclopenten-1-yl)amino]-7-oxo-1,3,5-heptatrien-1-yl]-2-oxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl]-, (2E,4E,6E)-
  • 2,4,6-Heptatrienamide, 7-cyclohexyl-N-[5-hydroxy-5-[7-[(2-hydroxy-5-oxo-1-cyclopenten-1-yl)amino]-7-oxo-1,3,5-heptatrienyl]-2-oxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl]-, [1S-[1α,3(2E,4E,6E),5β,5(1E,3E,5E),6α]]-
  • 2,4,6-Heptatrienamide, 7-cyclohexyl-N-[(1S,5S,6R)-5-hydroxy-5-[(1E,3E,5E)-7-[(2-hydroxy-5-oxo-1-cyclopenten-1-yl)amino]-7-oxo-1,3,5-heptatrienyl]-2-oxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl]-, (2E,4E,6E)-
  • 7-Oxabicyclo[4.1.0]heptane, 2,4,6-heptatrienamide deriv.
  • (2E,4E,6E)-7-Cyclohexyl-N-[(1S,5S,6R)-5-hydroxy-5-[(1E,3E,5E)-7-[(2-hydroxy-5-oxo-1-cyclopenten-1-yl)amino]-7-oxo-1,3,5-heptatrien-1-yl]-2-oxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl]-2,4,6-heptatrienamide

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration