Chemical Compound

C104H173F3N36O34S7

CAS Registry Number 1660960-77-9
C104H173F3N36O34S7 chemical structure
Primary Record

C104H173F3N36O34S7

In stock
1,946 g
Purity
98.2 %
CAS
1660960-77-9

Compound Identifiers & Properties

CAS
1660960-77-9
PubChem CID
176446723
SMILES
C[C@H]1C(=N[C@H](C(=N[C@H]2CSSC[C@H]3C(=N[C@H](C(=N[C@H](C(=NCC(=N[C@H](C(=N[C@@H](CSSC[C@@H](C(=N[C@@H](CSSC[C@@H](C(=N[C@H](C(=NCC(=N[C@H](C(=NCC(=N1)O)O)CCCCN)O)O)CCCCN)O)N)C(=N[C@H](C(=NCC(=N[C@H](C(=N3)O)CO)O)O)[C@@H](C)O)O)O)N=C([C@@H](N=C([C@@H](N=C([C@@H](N=C([C@@H](N=C([C@@H](N=C([C@@H](N=C2O)CO)O)CCCNC(=N)N)O)CC(C)C)O)CCSC)O)CC4=CC=C(C=C4)O)O)CC(=O)O)O)C(=N)O)O)CCCCN)O)O)CO)O)CCCNC(=N)N)O)O)CCCCN)O.C(=O)(C(F)(F)F)O
Canonical SMILES
CSCC[C@@H]1N=C(O)[C@H](CC(C)C)N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CO)N=C(O)[C@@H]2CSSC[C@@H]3N=C(O)[C@H](CO)N=C(O)CN=C(O)[C@H]([C@@H](C)O)N=C(O)[C@H](CSSC[C@H](N)C(O)=N[C@@H](CCCCN)C(O)=NCC(O)=N[C@@H](CCCCN)C(O)=NCC(O)=N[C@@H](C)C(O)=N[C@@H](CCCCN)C(O)=N2)N=C(O)[C@H](CSSC[C@@H](C(=N)O)N=C(O)[C@H](CCCCN)N=C(O)CN=C(O)[C@H](CO)N=C(O)[C@H](CCCNC(=N)N)N=C3O)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](Cc2ccc(O)cc2)N=C1O.O=C(O)C(F)(F)F

Names & Synonyms

  • C104H173F3N36O34S7
  • 1660960-77-9
  • 2-[(1R,4S,7S,13S,16R,21R,24S,27S,30S,33S,36S,39S,42R,45S,48S,54S,60S,63R,68R,71S,77S)-63-amino-13,45,54,60-tetrakis(4-aminobutyl)-16-carbamoyl-4,36-bis(3-guanidinopropyl)-71-[(1R)-1-hydroxyethyl]-7,39,77-tris(hydroxymethyl)-27-[(4-hydroxyphenyl)methyl]-33-isobutyl-48-methyl-30-(2-methylsulfanylethyl)-2,5,8,11,14,23,26,29,32,35,38,41,44,47,50,53,56,59,62,69,72,75,78,85-tetracosaoxo-18,19,65,66,81,82-hexathia-3,6,9,12,15,22,25,28,31,34,37,40,43,46,49,52,55,58,61,70,73,76,79,84-tetracosazatricyclo[40.37.4.221,68]pentaoctacontan-24-yl]acetic acid;2,2,2-trifluoroacetic acid
  • N/A