Viewing Compound With Structures

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Compound Report Overview

Compound Name: NEOPROTOVERATRINE
Compound Identifier: 705702
Mol Structure 2D: 705702
Molecular Weight: 810
Formula: C41 H63 N O15
Development Status: Preclinical
SMILES: CCC(C)C(=O)OC1C(O)C2C(CN3CC(C)CCC3C2(C)O)C4CC5(OC6(O)C7C(OC(=O)C)C(OC(=O)C)C5C41O)C7(C)CCC6OC(=O)C(C)(O)C(C)O
Activities CAS Curations Identifiers Literature Properties Similarities SMILES Structures Synonyms Targets
Compound Structures
>^ ISISHOST06100223002D 0 0.00000 0.00000 0^^ 63 69 0 1 0 999 V2000^ -0.7250 0.5083 0.0000 C 0 0 2 0 0 0 0 0 0^ -2.3083 -1.3125 0.0000 C 0 0 2 0 0 0 0 0 0^ -1.5083 -0.8417 0.0000 C 0 0 2 0 0 0 0 0 0^ 0.7125 0.6500 0.0000 C 0 0 2 0 0 0 0 0 0^ 0.0292 0.0458 0.0000 C 0 0 2 0 0 0 0 0 0^ -1.5083 0.0583 0.0000 C 0 0 2 0 0 0 0 0 0^ 1.7875 2.0875 0.0000 C 0 0 2 0 0 0 0 0 0^ 1.6000 0.5375 0.0000 C 0 0 2 0 0 0 0 0 0^ -1.4208 -1.9792 0.0000 O 0 0 0 0 0 0 0 0 0^ 2.3167 2.8208 0.0000 C 0 0 1 0 0 0 0 0 0^ 0.3500 1.4500 0.0000 C 0 0 2 0 0 0 0 0 0^ 1.0542 3.7333 0.0000 N 0 0 3 0 0 0 0 0 0^ 0.9042 2.1625 0.0000 C 0 0 2 0 0 0 0 0 0^ -0.7250 -1.3125 0.0000 C 0 0 2 0 0 0 0 0 0^ 0.0292 -0.8417 0.0000 C 0 0 1 0 0 0 0 0 0^ 2.1167 1.2625 0.0000 C 0 0 2 0 0 0 0 0 0^ 1.9417 3.6333 0.0000 C 0 0 1 0 0 0 0 0 0^ -3.8958 -2.1917 0.0000 C 0 0 0 0 0 0 0 0 0^ -4.6833 -2.6292 0.0000 C 0 0 1 0 0 0 0 0 0^ -0.5208 1.3625 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.1625 -0.1417 0.0000 O 0 0 0 0 0 0 0 0 0^ 0.5167 2.9958 0.0000 C 0 0 0 0 0 0 0 0 0^ -3.0833 -0.8417 0.0000 C 0 0 1 0 0 0 0 0 0^ 3.0667 -0.1750 0.0000 C 0 0 0 0 0 0 0 0 0^ -3.8958 -1.2917 0.0000 O 0 0 0 0 0 0 0 0 0^ -2.3083 0.5083 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.7125 -2.2042 0.0000 O 0 0 0 0 0 0 0 0 0^ 0.6417 -1.4792 0.0000 O 0 0 0 0 0 0 0 0 0^ 0.6667 4.5542 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.4542 4.3792 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.1208 -2.8792 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.5250 -1.6792 0.0000 C 0 0 0 0 0 0 0 0 0^ -3.1208 -2.6417 0.0000 O 0 0 0 0 0 0 0 0 0^ -2.3083 -2.2042 0.0000 O 0 0 0 0 0 0 0 0 0^ -3.0833 0.0458 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.6292 0.5375 0.0000 O 0 0 0 0 0 0 0 0 0^ 1.0792 -0.1750 0.0000 O 0 0 0 0 0 0 0 0 0^ -4.6875 -3.5292 0.0000 C 0 0 2 0 0 0 0 0 0^ 3.1667 2.5208 0.0000 O 0 0 0 0 0 0 0 0 0^ 0.7667 -2.6750 0.0000 O 0 0 0 0 0 0 0 0 0^ 2.1292 -1.0292 0.0000 O 0 0 0 0 0 0 0 0 0^ -5.1458 -1.8167 0.0000 O 0 0 0 0 0 0 0 0 0^ 3.0542 1.1750 0.0000 O 0 0 0 0 0 0 0 0 0^ 3.5000 -0.9542 0.0000 C 0 0 1 0 0 0 0 0 0^ -1.5000 0.9583 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.0167 3.4208 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.0625 5.2000 0.0000 C 0 0 0 0 0 0 0 0 0^ -5.6208 -2.6292 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.1917 5.2792 0.0000 C 0 0 2 0 0 0 0 0 0^ -3.9083 -4.0000 0.0000 O 0 0 0 0 0 0 0 0 0^ 1.7875 -2.5417 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.3750 -3.7375 0.0000 C 0 0 0 0 0 0 0 0 0^ 4.4167 -0.8000 0.0000 C 0 0 0 0 0 0 0 0 0^ -5.4708 -3.9792 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.1125 -1.7542 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.8417 6.1250 0.0000 C 0 0 0 0 0 0 0 0 0^ 4.8125 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.0833 0.9125 0.0000 H 0 0 0 0 0 0 0 0 0^ -2.2833 -0.3917 0.0000 H 0 0 0 0 0 0 0 0 0^ -0.3750 1.9750 0.0000 H 0 0 0 0 0 0 0 0 0^ 0.0542 2.4708 0.0000 H 0 0 0 0 0 0 0 0 0^ 2.6875 2.0083 0.0000 H 0 0 0 0 0 0 0 0 0^ 1.4250 2.9000 0.0000 H 0 0 0 0 0 0 0 0 0^ 2 9 1 6 0 0^ 3 6 1 0 0 0^ 4 5 1 0 0 0^ 5 1 1 0 0 0^ 6 1 1 0 0 0^ 7 13 1 0 0 0^ 8 4 1 0 0 0^ 1 9 1 6 0 0^ 10 7 1 0 0 0^ 11 20 1 0 0 0^ 12 22 1 0 0 0^ 13 11 1 0 0 0^ 14 3 1 0 0 0^ 15 5 1 0 0 0^ 16 8 1 0 0 0^ 17 12 1 0 0 0^ 18 25 1 0 0 0^ 19 18 1 0 0 0^ 20 1 1 0 0 0^ 8 21 1 6 0 0^ 22 13 1 0 0 0^ 23 2 1 0 0 0^ 24 21 1 0 0 0^ 23 25 1 1 0 0^ 26 6 1 0 0 0^ 14 27 1 6 0 0^ 15 28 1 6 0 0^ 29 12 1 0 0 0^ 30 17 1 0 0 0^ 31 27 1 0 0 0^ 32 28 1 0 0 0^ 33 18 2 0 0 0^ 34 2 1 0 0 0^ 35 26 1 0 0 0^ 36 24 2 0 0 0^ 4 37 1 6 0 0^ 38 19 1 0 0 0^ 10 39 1 1 0 0^ 40 31 2 0 0 0^ 41 32 2 0 0 0^ 19 42 1 1 0 0^ 16 43 1 1 0 0^ 44 24 1 0 0 0^ 6 45 1 1 0 0^ 46 10 1 0 0 0^ 47 49 1 0 0 0^ 48 19 1 0 0 0^ 49 29 1 0 0 0^ 38 50 1 6 0 0^ 51 32 1 0 0 0^ 52 31 1 0 0 0^ 53 44 1 0 0 0^ 54 38 1 0 0 0^ 44 55 1 1 0 0^ 49 56 1 1 0 0^ 57 53 1 0 0 0^ 5 58 1 1 0 0^ 3 59 1 1 0 0^ 11 60 1 6 0 0^ 13 61 1 1 0 0^ 7 62 1 6 0 0^ 17 63 1 6 0 0^ 11 4 1 0 0 0^ 2 3 1 0 0 0^ 14 15 1 0 0 0^ 23 35 1 0 0 0^ 7 16 1 0 0 0^ 17 10 1 0 0 0^ 47 30 1 0 0 0^M END^^
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