| Entry |
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| Name | Diphenhydramine laurylsulfate (JAN); Vena (TN) | ||||||||
| Formula | C12H26O4S. C17H21NO | ||||||||
| Exact mass | 521.3175 | ||||||||
| Mol weight | 521.7522 | ||||||||
| Structure |  | ||||||||
| Class | Anti-allergic agent DG01557 Histamine receptor antagonist DG01482 Histamine receptor H1 antagonist | ||||||||
| Remark |
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| Efficacy | Antiallergic, H1 receptor antagonist | ||||||||
| Comment | Diphenhydramine derivative | ||||||||
| Target | HRH1 [HSA:3269] [KO:K04149] | ||||||||
| Pathway |
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| Interaction | |||||||||
| Structure map |
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| Brite | Anatomical Therapeutic Chemical (ATC) classification [BR:br08303] D DERMATOLOGICALS D04 ANTIPRURITICS, INCL. ANTIHISTAMINES, ANESTHETICS, ETC. D04A ANTIPRURITICS, INCL. ANTIHISTAMINES, ANESTHETICS, ETC. D04AA Antihistamines for topical use D04AA32 Diphenhydramine D03360 Diphenhydramine laurylsulfate (JAN) <JP> R RESPIRATORY SYSTEM R06 ANTIHISTAMINES FOR SYSTEMIC USE R06A ANTIHISTAMINES FOR SYSTEMIC USE R06AA Aminoalkyl ethers R06AA02 Diphenhydramine D03360 Diphenhydramine laurylsulfate (JAN) <JP> USP drug classification [BR:br08302] Respiratory Tract/Pulmonary Agents Antihistamines Histamine (H1) Receptor Antagonists, Sedating Diphenhydramine D03360 Diphenhydramine laurylsulfate (JAN) Therapeutic category of drugs in Japan [BR:br08301] 2 Agents affecting individual organs 26 Epidermides 264 Analgesics, anti-itchings, astringents, anti-inflammatory agents 2642 Antihistamines for external use D03360 Diphenhydramine laurylsulfate (JAN) Classification of Japanese OTC drugs [BR:br08313] Agents for integumentary system 57 Analgesic, antipruritic, astringent, and anti-inflammatory remedies (incl. gel patches) D03360 Diphenhydramine laurylsulfate (JAN) Risk category of Japanese OTC drugs [BR:br08312] Third-class OTC drugs Inorganic and organic chemicals Diphenhydramine D03360 Diphenhydramine laurylsulfate (JAN) Drug groups [BR:br08330] Anti-allergic agent DG01557 Histamine receptor antagonist DG01482 Histamine receptor H1 antagonist DG00390 Diphenhydramine D03360 Diphenhydramine laurylsulfate Drug classes [BR:br08332] Anti-allergic agent DG01482 Histamine receptor H1 antagonist D03360 Diphenhydramine laurylsulfate Target-based classification of drugs [BR:br08310] G Protein-coupled receptors Rhodopsin family Histamine HRH1 D03360 Diphenhydramine laurylsulfate (JAN) <JP> Drug groups [BR:br08330] Anti-allergic agent DG01557 Histamine receptor antagonist DG01482 Histamine receptor H1 antagonist DG00390 Diphenhydramine | ||||||||
| Other DBs |
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| KCF data | ATOM 36 1 C1c C 20.7534 -18.7629 2 C8y C 19.5421 -19.4675 3 C8y C 21.9707 -19.4675 4 O2a O 20.7593 -17.3651 5 C8x C 19.5421 -20.8712 6 C8x C 18.3306 -18.7629 7 C8x C 21.9650 -20.8712 8 C8x C 23.1762 -18.7629 9 C1b C 21.9707 -16.6604 10 C8x C 18.3306 -21.5641 11 C8x C 17.1133 -19.4675 12 C8x C 23.1762 -21.5641 13 C8x C 24.3935 -19.4675 14 C8x C 17.1133 -20.8712 15 C8x C 24.3876 -20.8712 16 C1b C 23.2072 -17.3717 17 N1c N 24.4042 -16.6780 18 C1a C 25.5940 -17.3624 19 C1a C 24.4020 -15.2685 20 C1b C 43.4700 -19.3900 21 C1b C 42.2800 -20.0900 22 C1b C 41.0900 -19.3900 23 C1b C 39.8300 -20.0900 24 C1b C 38.6400 -19.3900 25 C1b C 37.4500 -20.0900 26 C1b C 36.2600 -19.3900 27 C1b C 35.0700 -20.0900 28 C1b C 33.8100 -19.3900 29 C1b C 32.6200 -20.0900 30 C1b C 31.4300 -19.3900 31 O2a O 30.2400 -20.0900 32 C1a C 44.7300 -20.0900 33 S4a S 28.8400 -20.0900 34 O1d O 27.4400 -20.0900 35 O1d O 28.8400 -18.6900 36 O1d O 28.8400 -21.4900 BOND 36 1 5 10 2 2 6 11 1 3 7 12 1 4 8 13 2 5 10 14 1 6 12 15 2 7 11 14 2 8 13 15 1 9 1 2 1 10 1 3 1 11 1 4 1 12 2 5 1 13 2 6 2 14 3 7 2 15 3 8 1 16 4 9 1 17 9 16 1 18 16 17 1 19 17 18 1 20 17 19 1 21 20 21 1 22 21 22 1 23 22 23 1 24 23 24 1 25 24 25 1 26 25 26 1 27 26 27 1 28 27 28 1 29 28 29 1 30 29 30 1 31 30 31 1 32 20 32 1 33 31 33 1 34 33 34 1 35 33 35 2 36 33 36 2 |