Viewing Compound With Structures

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Compound Report Overview

Compound Name: DESMOPRESSIN
Compound Identifier: 700084
Mol Structure 2D: 700084
Molecular Weight: 1087
Formula: C46 H64 N14 O12 S2 . H2 O
Development Status: US FDA Approved
SMILES: O.NC(=N)NCCCC(NC(=O)C1CCCN1C(=O)C2CSSCCC(=O)NC(Cc3ccc(O)cc3)C(=O)NC(Cc4ccccc4)C(=O)NC(CCC(=O)N)C(=O)NC(CC(=O)N)C(=O)N2)C(=O)NCC(=O)N
Activities CAS Curations Identifiers Literature Properties Similarities SMILES Structures Synonyms Targets
Compound Structures
>^ ISISHOST06100222082D 0 0.00000 0.00000 0^^ 75 77 0 1 0 999 V2000^ 6.6625 -2.1917 0.0000 N 0 0 3 0 0 0 0 0 0^ 6.0542 -2.5625 0.0000 C 0 0 0 0 0 0 0 0 0^ 5.4417 -2.2125 0.0000 C 0 0 1 0 0 0 0 0 0^ 4.8417 -2.5625 0.0000 N 0 0 0 0 0 0 0 0 0^ 3.0792 -2.2167 0.0000 N 0 0 0 0 0 0 0 0 0^ -0.5500 -2.2125 0.0000 N 0 0 0 0 0 0 0 0 0^ 1.2875 -2.5625 0.0000 N 0 0 0 0 0 0 0 0 0^ 4.2875 -2.2125 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.1458 -2.5625 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.6750 -2.2167 0.0000 C 0 0 0 0 0 0 0 0 0^ 7.9667 -2.5625 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.5042 -2.5625 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.6750 -2.5625 0.0000 C 0 0 2 0 0 0 0 0 0^ 7.3542 -2.1917 0.0000 C 0 0 2 0 0 0 0 0 0^ -2.3458 -2.5625 0.0000 N 0 0 0 0 0 0 0 0 0^ 0.0625 -2.5625 0.0000 C 0 0 2 0 0 0 0 0 0^ -1.7333 -2.2125 0.0000 C 0 0 1 0 0 0 0 0 0^ 8.5542 -2.1917 0.0000 N 0 0 0 0 0 0 0 0 0^ 3.6750 -3.6292 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.9042 -2.2167 0.0000 C 0 0 2 0 0 0 0 0 0^ -2.9583 -2.2125 0.0000 C 0 0 0 0 0 0 0 0 0^ 9.7292 -2.1917 0.0000 C 0 0 0 0 0 0 0 0 0^ 10.9042 -4.3292 0.0000 C 0 0 0 0 0 0 0 0 0^ 4.2625 -4.0042 0.0000 C 0 0 0 0 0 0 0 0 0^ 10.2917 -2.5375 0.0000 N 0 0 0 0 0 0 0 0 0^ 4.8542 0.8333 0.0000 S 0 0 0 0 0 0 0 0 0^ 9.1167 -2.5375 0.0000 C 0 0 1 0 0 0 0 0 0^ -1.7375 0.8333 0.0000 S 0 0 0 0 0 0 0 0 0^ 11.5042 -2.5375 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.4417 -0.5042 0.0000 C 0 0 0 0 0 0 0 0 0^ 10.9042 -3.6292 0.0000 N 0 0 0 0 0 0 0 0 0^ 6.0542 -3.2417 0.0000 O 0 0 0 0 0 0 0 0 0^ 7.9667 -3.2417 0.0000 O 0 0 0 0 0 0 0 0 0^ 0.6750 -1.5792 0.0000 O 0 0 0 0 0 0 0 0 0^ 4.2875 -1.5792 0.0000 O 0 0 0 0 0 0 0 0 0^ -1.1458 -3.2417 0.0000 O 0 0 0 0 0 0 0 0 0^ 2.5042 -3.2417 0.0000 O 0 0 0 0 0 0 0 0 0^ 5.4375 0.4208 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.7333 -1.3792 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.0625 -3.4250 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.9583 0.8333 0.0000 C 0 0 0 0 0 0 0 0 0^ 9.7292 -1.5375 0.0000 O 0 0 0 0 0 0 0 0 0^ -3.5250 -2.5625 0.0000 O 0 0 0 0 0 0 0 0 0^ 4.2625 -4.6667 0.0000 O 0 0 0 0 0 0 0 0 0^ 11.5042 -3.2417 0.0000 O 0 0 0 0 0 0 0 0 0^ 1.8542 -0.1542 0.0000 O 0 0 0 0 0 0 0 0 0^ 1.9042 -1.5375 0.0000 C 0 0 0 0 0 0 0 0 0^ 10.2792 -4.6917 0.0000 N 0 0 0 0 0 0 0 0 0^ 10.9042 -2.1917 0.0000 C 0 0 0 0 0 0 0 0 0^ 11.4625 -4.6500 0.0000 N 0 0 0 0 0 0 0 0 0^ 6.4417 -1.5375 0.0000 C 0 0 0 0 0 0 0 0 0^ 4.8250 -3.6500 0.0000 N 0 0 0 0 0 0 0 0 0^ 2.4417 -1.1667 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.1875 -1.0792 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.0375 -0.1542 0.0000 N 0 0 0 0 0 0 0 0 0^ 12.0917 -2.2125 0.0000 N 0 0 0 0 0 0 0 0 0^ 0.0042 -0.4042 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.6417 -3.7542 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.3458 1.1458 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.1875 -0.4042 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.5500 -1.4167 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.5500 -0.0417 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.0042 -1.0792 0.0000 C 0 0 0 0 0 0 0 0 0^ 7.5667 -1.5375 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.6000 -0.0417 0.0000 O 0 0 0 0 0 0 0 0 0^ 7.0125 -1.1542 0.0000 C 0 0 0 0 0 0 0 0 0^ 9.1167 -3.2792 0.0000 C 0 0 0 0 0 0 0 0 0^ 9.7042 -4.3292 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.6417 -4.4250 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.2167 -3.3917 0.0000 C 0 0 0 0 0 0 0 0 0^ 9.7292 -3.6292 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.2167 -4.7625 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.8292 -3.7542 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.8292 -4.4250 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.0667 -3.2542 0.0000 O 0 0 0 0 0 0 0 0 0^ 2 1 1 0 0 0^ 3 2 1 0 0 0^ 4 3 1 0 0 0^ 5 13 1 0 0 0^ 6 9 1 0 0 0^ 7 20 1 0 0 0^ 8 4 1 0 0 0^ 9 17 1 0 0 0^ 10 7 1 0 0 0^ 14 11 1 1 0 0^ 12 5 1 0 0 0^ 13 8 1 0 0 0^ 14 1 1 0 0 0^ 15 21 1 0 0 0^ 16 10 1 0 0 0^ 17 15 1 0 0 0^ 18 11 1 0 0 0^ 13 19 1 6 0 0^ 20 12 1 0 0 0^ 21 41 1 0 0 0^ 22 27 1 0 0 0^ 23 48 1 0 0 0^ 24 19 1 0 0 0^ 25 22 1 0 0 0^ 26 38 1 0 0 0^ 27 18 1 0 0 0^ 28 26 1 0 0 0^ 29 49 1 0 0 0^ 30 53 1 0 0 0^ 31 23 2 0 0 0^ 32 2 2 0 0 0^ 33 11 2 0 0 0^ 34 10 2 0 0 0^ 35 8 2 0 0 0^ 36 9 2 0 0 0^ 37 12 2 0 0 0^ 3 38 1 1 0 0^ 17 39 1 1 0 0^ 16 40 1 6 0 0^ 41 59 1 0 0 0^ 42 22 2 0 0 0^ 43 21 2 0 0 0^ 44 24 2 0 0 0^ 45 29 2 0 0 0^ 46 30 2 0 0 0^ 20 47 1 1 0 0^ 48 68 1 0 0 0^ 49 25 1 0 0 0^ 50 23 1 0 0 0^ 51 1 1 0 0 0^ 52 24 1 0 0 0^ 53 47 1 0 0 0^ 54 39 1 0 0 0^ 55 30 1 0 0 0^ 56 29 1 0 0 0^ 57 63 2 0 0 0^ 58 40 1 0 0 0^ 59 28 1 0 0 0^ 60 54 1 0 0 0^ 61 54 2 0 0 0^ 62 60 2 0 0 0^ 63 61 1 0 0 0^ 64 14 1 0 0 0^ 65 57 1 0 0 0^ 66 51 1 0 0 0^ 27 67 1 1 0 0^ 68 71 1 0 0 0^ 69 58 1 0 0 0^ 70 58 2 0 0 0^ 71 67 1 0 0 0^ 72 69 2 0 0 0^ 73 70 1 0 0 0^ 74 73 2 0 0 0^ 66 64 1 0 0 0^ 6 16 1 0 0 0^ 57 62 1 0 0 0^ 74 72 1 0 0 0^M END^^
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