Nosiheptide

CAS Registry Number®

56377-79-8

CAS Name

Nosiheptide

Molecular Formula

C51H43N13O12S6

Molecular Mass

1222.36

Cite this Page

Nosiheptide.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=56377-79-8 (retrieved 2024-11-22) (CAS RN: 56377-79-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    310-320 °C (decomp)

Source(s)

  • (1) Drugs - Synonyms and Properties data were obtained from Ashgate Publishing Co. (US)

Other Names and Identifiers

InChI

InChI=1S/C51H43N13O12S6/c1-5-23-46-60-28(14-79-46)41(70)56-25-10-33(67)50(74)76-11-21-7-6-8-24-34(21)18(2)35(54-24)51(75)82-17-31(57-42(71)29-15-80-47(25)61-29)48-58-26(12-78-48)37-22(45-59-30(13-77-45)43(72)64-36(20(4)65)44(73)55-23)9-32(66)38(63-37)49-62-27(16-81-49)40(69)53-19(3)39(52)68/h5-9,12-16,20,25,31,33,36,54,65-67H,3,10-11,17H2,1-2,4H3,(H2,52,68)(H,53,69)(H,55,73)(H,56,70)(H,57,71)(H,64,72)

InChIKey

InChIKey=OQAOHXRUMXWDLQ-UHFFFAOYSA-N

SMILES

OC=1C=C2C(C=3N=C(SC3)C4NC(=O)C=5N=C(SC5)C(NC(=O)C=6N=C(C(=CC)NC(=O)C(C(C)O)NC(=O)C=7N=C2SC7)SC6)CC(O)C(=O)OCC8=C9C(C)=C(C(=O)SC4)NC9=CC=C8)=NC1C%10=NC(C(NC(C(N)=O)=C)=O)=CS%10

Canonical SMILES

O=C1SCC2NC(=O)C=3N=C(SC3)C(NC(=O)C=4N=C(SC4)C(=CC)NC(=O)C(NC(=O)C=5N=C(SC5)C=6C=C(O)C(=NC6C=7N=C2SC7)C8=NC(=CS8)C(=O)NC(=C)C(=O)N)C(O)C)CC(O)C(=O)OCC=9C=CC=C%10NC1=C(C%109)C

Other Names for this Substance

  • 4-Thiazolecarboxamide, N-[1-(aminocarbonyl)ethenyl]-2-[(11S,14Z,21S,23S,29S)-14-ethylidene-9,10,11,12,13,14,19,20,21,22,23,24,26,33,35,36-hexadecahydro-3,23-dihydroxy-11-[(1R)-1-hydroxyethyl]-31-methyl-9,12,19,24,33,43-hexaoxo-30,32-imino-8,5:18,15:40,37-trinitrilo-21,36-([2,4]-endo-thiazolomethanimino)-5H,15H,37H-pyrido[3,2-w][2,11,21,27,31,7,14,17]benzoxatetrathiatriazacyclohexatriacontin-2-yl]-
  • Nosiheptide
  • 30,32-Imino-8,5:18,15:40,37-trinitrilo-21,36-([2,4]-endo-thiazolomethanimino)-5H,15H,37H-pyrido[3,2-w][2,11,21,27,31,7,14,17]benzoxatetrathiatriazacyclohexatriacontine, nosiheptide deriv.
  • N-[1-(Aminocarbonyl)ethenyl]-2-[(11S,14Z,21S,23S,29S)-14-ethylidene-9,10,11,12,13,14,19,20,21,22,23,24,26,33,35,36-hexadecahydro-3,23-dihydroxy-11-[(1R)-1-hydroxyethyl]-31-methyl-9,12,19,24,33,43-hexaoxo-30,32-imino-8,5:18,15:40,37-trinitrilo-21,36-([2,4]-endo-thiazolomethanimino)-5H,15H,37H-pyrido[3,2-w][2,11,21,27,31,7,14,17]benzoxatetrathiatriazacyclohexatriacontin-2-yl]-4-thiazolecarboxamide
  • Multhiomycin

View All

Deleted or Replaced CAS Registry Numbers

11057-08-2, 51668-49-6, 65454-47-9

CAS INSIGHTSTM
Targeted protein degrader structure, illustration