Wikidata

(Q110171282)

English

(3S,6S,9S,12S,15S,18S,21S)-15-[(E)-but-2-enyl]-6-[(4-hydroxy-3-nitrophenyl)methyl]-1,3,10-trimethyl-12-[[1-(2-methylbut-3-en-2-yl)indol-3-yl]methyl]-9,18,21-tris(2-methylpropyl)-1,4,7,10,13,16,19-heptazacyclohenicosane-2,5,8,11,14,17,20-heptone

chemical compound

In more languages

Statements

mass
1,011.579339664 dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₅₄H₇₇N₉O₁₀
0 references
canonical SMILES
O=C1NC(C(=O)N(C)C(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N(C)C(C(=O)NC1CC2=CC=C(O)C(=C2)[N+](=O)[O-])CC(C)C)CC3=CN(C=4C=CC=CC43)C(C=C)(C)C)CC=CC)CC(C)C)CC(C)C)C
0 references
isomeric SMILES
C=CC(C)(C)n1cc(C[C@@H]2NC(=O)[C@H](C/C=C/C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](C)NC(=O)[C@H](Cc3ccc(O)c([N+](=O)[O-])c3)NC(=O)[C@H](CC(C)C)N(C)C2=O)c2ccccc21
0 references

Identifiers

 
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