Viewing Compound With Structures

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Compound Report Overview

Compound Name: RBI 257 MALEATE
Compound Identifier: 700941
Mol Structure 2D: 700941
Molecular Weight: 465
Formula: C21 H28 I N3 O
Development Status: Biochemical standard
SMILES: CC(C)Oc1cccc(CNC2CCN(Cc3ccc(I)cc3)CC2)n1
Activities CAS Curations Identifiers Literature Properties Similarities SMILES Structures Synonyms Targets
Compound Structures
>^ ISISHOST06100222242D 0 0.00000 0.00000 0^^ 26 28 0 0 0 999 V2000^ 2.5792 -6.0000 0.0000 N 0 0 0 0 0 0 0 0 0^ 1.1500 -7.6667 0.0000 N 0 0 3 0 0 0 0 0 0^ 3.3000 -6.4167 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.3000 -7.2542 0.0000 O 0 0 0 0 0 0 0 0 0^ 1.1500 -5.1667 0.0000 N 0 0 0 0 0 0 0 0 0^ 1.1500 -8.4917 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.8625 -6.4167 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.4375 -6.4167 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.5792 -5.1667 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.4375 -7.2542 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.8625 -7.2542 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.1500 -6.0000 0.0000 C 0 0 3 0 0 0 0 0 0^ 1.8625 -8.9125 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.8625 -4.7542 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.3042 -9.7167 0.0000 C 0 0 0 0 0 0 0 0 0^ 4.0167 -10.1250 0.0000 I 0 0 0 0 0 0 0 0 0^ 3.3042 -8.8917 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.5917 -10.1292 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.8667 -9.7250 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.5917 -8.4792 0.0000 C 0 0 0 0 0 0 0 0 0^ 4.0167 -6.0000 0.0000 C 0 0 0 0 0 0 0 0 0^ 4.0167 -5.1667 0.0000 C 0 0 0 0 0 0 0 0 0^ 4.0167 -7.6667 0.0000 C 0 0 3 0 0 0 0 0 0^ 3.3000 -4.7542 0.0000 C 0 0 0 0 0 0 0 0 0^ 4.7292 -7.2417 0.0000 C 0 0 0 0 0 0 0 0 0^ 4.0167 -8.4792 0.0000 C 0 0 0 0 0 0 0 0 0^ 2 10 1 0 0 0^ 3 1 1 0 0 0^ 4 3 1 0 0 0^ 5 14 1 0 0 0^ 6 2 1 0 0 0^ 7 12 1 0 0 0^ 8 12 1 0 0 0^ 9 1 2 0 0 0^ 10 8 1 0 0 0^ 11 7 1 0 0 0^ 12 5 1 0 0 0^ 13 6 1 0 0 0^ 14 9 1 0 0 0^ 15 17 1 0 0 0^ 16 15 1 0 0 0^ 17 20 2 0 0 0^ 18 19 1 0 0 0^ 19 13 2 0 0 0^ 20 13 1 0 0 0^ 21 3 2 0 0 0^ 22 24 2 0 0 0^ 23 4 1 0 0 0^ 24 9 1 0 0 0^ 25 23 1 0 0 0^ 26 23 1 0 0 0^ 22 21 1 0 0 0^ 2 11 1 0 0 0^ 15 18 2 0 0 0^M END^^
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