Viewing Compound With Structures

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Compound Report Overview

Compound Name: BROMOCRIPTINE
Compound Identifier: 704359
Mol Structure 2D: 704359
Molecular Weight: 655
Formula: C32 H40 Br N5 O5
Development Status: US FDA Approved
SMILES: CC(C)CC1N2C(=O)C(NC(=O)C3CN(C)C4Cc5c(Br)[nH]c6cccc(C4=C3)c56)(OC2(O)C7CCCN7C1=O)C(C)C
Activities CAS Curations Identifiers Literature Properties Similarities SMILES Structures Synonyms Targets
Compound Structures
>^ ISISHOST06100222052D 0 0.00000 0.00000 0^^ 45 51 0 1 0 999 V2000^ 9.7833 -0.1000 0.0000 O 0 0 0 0 0 0 0 0 0^ 11.1315 -2.2148 0.0000 C 0 0 0 0 0 0 0 0 0^ 12.3686 -2.9137 0.0000 C 0 0 0 0 0 0 0 0 0^ 12.9223 -3.4379 0.0000 C 0 0 0 0 0 0 0 0 0^ 11.7569 -3.2764 0.0000 C 0 0 0 0 0 0 0 0 0^ 11.1366 -2.9260 0.0000 C 0 0 0 0 0 0 0 0 0^ 11.7412 -1.8558 0.0000 C 0 0 2 0 0 0 0 0 0^ 10.5112 -1.8644 0.0000 C 0 0 0 0 0 0 0 0 0^ 12.5760 -4.0947 0.0000 N 0 0 0 0 0 0 0 0 0^ 10.5005 -1.1548 0.0000 C 0 0 1 0 0 0 0 0 0^ 11.7382 -1.1410 0.0000 N 0 0 3 0 0 0 0 0 0^ 9.7926 -0.7794 0.0000 C 0 0 0 0 0 0 0 0 0^ 11.7640 -3.9839 0.0000 C 0 0 0 0 0 0 0 0 0^ 12.3615 -2.2062 0.0000 C 0 0 0 0 0 0 0 0 0^ 11.1178 -0.7906 0.0000 C 0 0 0 0 0 0 0 0 0^ 13.5252 -3.4332 0.0000 Br 0 0 0 0 0 0 0 0 0^ 10.5269 -3.2850 0.0000 C 0 0 0 0 0 0 0 0 0^ 12.3478 -0.7820 0.0000 C 0 0 0 0 0 0 0 0 0^ 11.1503 -4.3502 0.0000 C 0 0 0 0 0 0 0 0 0^ 10.5299 -3.9998 0.0000 C 0 0 0 0 0 0 0 0 0^ 12.3622 -1.4935 0.0000 H 0 0 0 0 0 0 0 0 0^ 7.2364 -0.5928 0.0000 N 0 0 3 0 0 0 0 0 0^ 7.5069 -1.2577 0.0000 C 0 0 1 0 0 0 0 0 0^ 8.4273 -0.6196 0.0000 C 0 0 1 0 0 0 0 0 0^ 7.8344 -0.1697 0.0000 C 0 0 0 0 0 0 0 0 0^ 8.1864 -1.2492 0.0000 O 0 0 0 0 0 0 0 0 0^ 6.5216 -0.4857 0.0000 C 0 0 2 0 0 0 0 0 0^ 6.0675 -1.0523 0.0000 C 0 0 0 0 0 0 0 0 0^ 6.3453 -1.7213 0.0000 N 0 0 3 0 0 0 0 0 0^ 9.0292 -1.0027 0.0000 N 0 0 0 0 0 0 0 0 0^ 7.1112 -1.8607 0.0000 C 0 0 1 0 0 0 0 0 0^ 7.8520 0.5477 0.0000 O 0 0 0 0 0 0 0 0 0^ 5.3637 -0.9514 0.0000 O 0 0 0 0 0 0 0 0 0^ 7.9509 -1.7517 0.0000 O 0 0 0 0 0 0 0 0 0^ 6.2548 0.1771 0.0000 C 0 0 0 0 0 0 0 0 0^ 8.6648 0.0550 0.0000 C 0 0 3 0 0 0 0 0 0^ 5.9757 -2.3500 0.0000 C 0 0 0 0 0 0 0 0 0^ 7.1584 -2.6114 0.0000 C 0 0 0 0 0 0 0 0 0^ 6.4603 -2.9492 0.0000 C 0 0 0 0 0 0 0 0 0^ 5.4881 0.4358 0.0000 C 0 0 3 0 0 0 0 0 0^ 8.4450 0.6147 0.0000 C 0 0 0 0 0 0 0 0 0^ 9.4202 0.2497 0.0000 C 0 0 0 0 0 0 0 0 0^ 4.8295 0.0603 0.0000 C 0 0 0 0 0 0 0 0 0^ 5.4567 1.2147 0.0000 C 0 0 0 0 0 0 0 0 0^ 7.6122 -2.1888 0.0000 H 0 0 0 0 0 0 0 0 0^ 12 1 2 0 0 0^ 2 8 2 0 0 0^ 3 14 1 0 0 0^ 4 3 2 0 0 0^ 5 6 1 0 0 0^ 6 2 1 0 0 0^ 7 11 1 0 0 0^ 8 10 1 0 0 0^ 9 13 1 0 0 0^ 10 12 1 1 0 0^ 11 15 1 0 0 0^ 13 5 2 0 0 0^ 14 7 1 0 0 0^ 15 10 1 0 0 0^ 16 4 1 0 0 0^ 17 6 2 0 0 0^ 18 11 1 0 0 0^ 19 20 2 0 0 0^ 20 17 1 0 0 0^ 7 21 1 1 0 0^ 7 2 1 0 0 0^ 3 5 1 0 0 0^ 19 13 1 0 0 0^ 9 4 1 0 0 0^ 23 22 1 0 0 0^ 24 25 1 0 0 0^ 25 22 1 0 0 0^ 26 23 1 0 0 0^ 27 22 1 0 0 0^ 28 27 1 0 0 0^ 29 28 1 0 0 0^ 30 24 1 0 0 0^ 31 23 1 0 0 0^ 32 25 2 0 0 0^ 33 28 2 0 0 0^ 23 34 1 6 0 0^ 27 35 1 6 0 0^ 24 36 1 1 0 0^ 37 29 1 0 0 0^ 38 31 1 0 0 0^ 39 38 1 0 0 0^ 40 35 1 0 0 0^ 41 36 1 0 0 0^ 42 36 1 0 0 0^ 43 40 1 0 0 0^ 44 40 1 0 0 0^ 31 45 1 1 0 0^ 29 31 1 0 0 0^ 24 26 1 0 0 0^ 39 37 1 0 0 0^ 12 30 1 0 0 0^M END^^
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