Viewing Compound With Structures

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Compound Report Overview

Compound Name: PHORBOL 12-MYRISTATE 13-ACETATE
Compound Identifier: 706538
Mol Structure 2D: 706538
Molecular Weight: 617
Formula: C36 H56 O8
Development Status: Biochemical standard
SMILES: CCCCCCCCCCCCCC(=O)OC1C(C)C2(O)C3C=C(C)C(=O)C3(O)CC(=CC2C4C(C)(C)C41OC(=O)C)CO
Activities CAS Curations Identifiers Literature Properties Similarities SMILES Structures Synonyms Targets
Compound Structures
>^ ISISHOST06100222192D 0 0.00000 0.00000 0^^ 47 50 0 1 0 999 V2000^ 0.7417 -1.5042 0.0000 C 0 0 2 0 0 0 0 0 0^ 0.8167 -1.9542 0.0000 C 0 0 1 0 0 0 0 0 0^ 1.1792 -1.6542 0.0000 C 0 0 3 0 0 0 0 0 0^ 0.0500 -2.0667 0.0000 C 0 0 2 0 0 0 0 0 0^ -0.3375 -2.3042 0.0000 C 0 0 1 0 0 0 0 0 0^ -0.4208 -2.7500 0.0000 C 0 0 1 0 0 0 0 0 0^ 0.4542 -2.2417 0.0000 C 0 0 1 0 0 0 0 0 0^ 0.3167 -1.3417 0.0000 C 0 0 1 0 0 0 0 0 0^ -0.0125 -1.6042 0.0000 C 0 0 1 0 0 0 0 0 0^ -0.7625 -2.1042 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.8625 -2.8292 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.0708 -2.4292 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.6000 -2.6667 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.9167 -1.0750 0.0000 O 0 0 0 0 0 0 0 0 0^ 0.2750 -0.8792 0.0000 O 0 0 0 0 0 0 0 0 0^ 0.3375 -3.0375 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.0958 -3.0667 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.7750 -0.6167 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.1708 -0.7167 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.0708 -3.2375 0.0000 O 0 0 0 0 0 0 0 0 0^ 0.1042 -2.5417 0.0000 O 0 0 0 0 0 0 0 0 0^ -0.5583 -3.1417 0.0000 O 0 0 0 0 0 0 0 0 0^ 0.3375 -0.5125 0.0000 O 0 0 0 0 0 0 0 0 0^ -0.5125 -1.0167 0.0000 O 0 0 0 0 0 0 0 0 0^ 1.4292 -1.2750 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.5292 -1.9542 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.4458 -1.4625 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.5375 -2.3542 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.5667 -3.4375 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.0375 -3.5042 0.0000 O 0 0 0 0 0 0 0 0 0^ -0.2375 -0.2542 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.1000 -0.2917 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.0167 0.1208 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.2583 3.2333 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.6583 2.8958 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.4708 1.1625 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.0958 1.4208 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.5958 1.7458 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.1708 1.9625 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.6083 2.2958 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.2125 2.6208 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.4208 0.4208 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.0458 0.8375 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.7208 3.5958 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.1042 -2.3917 0.0000 H 0 0 0 0 0 0 0 0 0^ 0.4750 -1.8125 0.0000 H 0 0 0 0 0 0 0 0 0^ -0.5083 -1.8625 0.0000 H 0 0 0 0 0 0 0 0 0^ 2 1 1 0 0 0^ 3 1 1 0 0 0^ 4 9 1 0 0 0^ 5 4 1 0 0 0^ 6 5 1 0 0 0^ 7 2 1 0 0 0^ 8 1 1 0 0 0^ 9 8 1 0 0 0^ 10 5 1 0 0 0^ 11 6 1 0 0 0^ 12 10 2 0 0 0^ 13 7 1 0 0 0^ 1 14 1 6 0 0^ 8 15 1 1 0 0^ 16 13 2 0 0 0^ 17 16 1 0 0 0^ 18 14 1 0 0 0^ 19 15 1 0 0 0^ 20 11 2 0 0 0^ 4 21 1 6 0 0^ 6 22 1 1 0 0^ 23 18 2 0 0 0^ 24 19 2 0 0 0^ 25 3 1 0 0 0^ 26 3 1 0 0 0^ 9 27 1 6 0 0^ 28 12 1 0 0 0^ 29 16 1 0 0 0^ 30 29 1 0 0 0^ 31 19 1 0 0 0^ 32 18 1 0 0 0^ 33 31 1 0 0 0^ 34 35 1 0 0 0^ 35 41 1 0 0 0^ 36 43 1 0 0 0^ 37 36 1 0 0 0^ 38 37 1 0 0 0^ 39 38 1 0 0 0^ 40 39 1 0 0 0^ 41 40 1 0 0 0^ 42 33 1 0 0 0^ 43 42 1 0 0 0^ 44 34 1 0 0 0^ 2 45 1 6 0 0^ 7 46 1 1 0 0^ 5 47 1 6 0 0^ 3 2 1 0 0 0^ 4 7 1 0 0 0^ 17 6 1 0 0 0^ 12 11 1 0 0 0^M END^^
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