Amentoflavone (BioDeep_00000003345)
Secondary id: BioDeep_00000330658
human metabolite PANOMIX_OTCML-2023 Endogenous
代谢物信息卡片
化学式: C30H18O10 (538.0899928)
中文名称: 穗花杉双黄酮, 阿曼托黄酮
谱图信息:
最多检出来源 Viridiplantae(plant) 8.39%
分子结构信息
SMILES: c1(cc(c2c(c1)oc(cc2=O)c1cc(c(cc1)O)c1c(cc(c2c1oc(cc2=O)c1ccc(cc1)O)O)O)O)O
InChI: InChI=1S/C30H18O10/c31-15-4-1-13(2-5-15)24-12-23(38)29-21(36)10-20(35)27(30(29)40-24)17-7-14(3-6-18(17)33)25-11-22(37)28-19(34)8-16(32)9-26(28)39-25/h1-12,31-36H
描述信息
Amentoflavone is a biflavonoid that is obtained by oxidative coupling of two molecules of apigenin resulting in a bond between positions C-3 of the hydroxyphenyl ring and C-8 of the chromene ring. A natural product found particularly in Ginkgo biloba and Hypericum perforatum. It has a role as a cathepsin B inhibitor, an antiviral agent, an angiogenesis inhibitor, a P450 inhibitor and a plant metabolite. It is a biflavonoid, a hydroxyflavone and a ring assembly.
Amentoflavone is a natural product found in Podocarpus elongatus, Austrocedrus chilensis, and other organisms with data available.
A biflavonoid that is obtained by oxidative coupling of two molecules of apigenin resulting in a bond between positions C-3 of the hydroxyphenyl ring and C-8 of the chromene ring. A natural product found particularly in Ginkgo biloba and Hypericum perforatum.
D004791 - Enzyme Inhibitors > D065607 - Cytochrome P-450 Enzyme Inhibitors > D065688 - Cytochrome P-450 CYP2C9 Inhibitors
D004791 - Enzyme Inhibitors > D065607 - Cytochrome P-450 Enzyme Inhibitors > D065692 - Cytochrome P-450 CYP3A Inhibitors
Amentoflavone is found in fruits. Amentoflavone is obtained from Viburnum prunifolium (black haw
Amentoflavone (Didemethyl-ginkgetin) is a potent and orally active GABA(A) negative modulator. Amentoflavone also shows anti-inflammatory, antioxidative, anti-viral, anti-tumor, anti-radiation, anti-fungal, antibacterial activity. Amentoflavone induces apoptosis and cell cycle arrest at sub-G1 phase[1][2][3][4].
Amentoflavone (Didemethyl-ginkgetin) is a potent and orally active GABA(A) negative modulator. Amentoflavone also shows anti-inflammatory, antioxidative, anti-viral, anti-tumor, anti-radiation, anti-fungal, antibacterial activity. Amentoflavone induces apoptosis and cell cycle arrest at sub-G1 phase[1][2][3][4].
Amentoflavone (Didemethyl-ginkgetin) is a potent and orally active GABA(A) negative modulator. Amentoflavone also shows anti-inflammatory, antioxidative, anti-viral, anti-tumor, anti-radiation, anti-fungal, antibacterial activity. Amentoflavone induces apoptosis and cell cycle arrest at sub-G1 phase[1][2][3][4].
同义名列表
31 个代谢物同义名
4H-1-Benzopyran-4-one, 8-(5-(5,7-dihydroxy-4-oxo-4H-1-benzopyran-2-yl)-2-hydroxyphenyl)-5,7-dihydroxy-2-(4-hydroxyphenyl)-; 4H-1-Benzopyran-4-one, 8-[5-(5,7-dihydroxy-4-oxo-4H-1-benzopyran-2-yl)-2-hydroxyphenyl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-; 4H-1-Benzopyran-4-one, 8-[5-(5,7-dihydroxy-4-oxo-4H-1-benzopyran-2-yl)-2-hydroxyphenyl]-5,7-dihydroxy-2-(4-hydroxyphenyl); 8-(5-(5,7-dihydroxy-4-oxo-4H-1-benzopyran-2-yl)-2-hydroxyphenyl)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one; 8-[5-(5,7-dihydroxy-4-oxo-chromen-2-yl)-2-hydroxy-phenyl]-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one;Amentoflavone; 8-[5-(5,7-dihydroxy-4-oxo-4H-chromen-2-yl)-2-hydroxyphenyl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one; 8-(5-(5,7-Dihydroxy-4-oxo-4H-chromen-2-yl)-2-hydroxyphenyl)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one; 8-[5-(5,7-dihydroxy-4-oxo-chromen-2-yl)-2-hydroxy-phenyl]-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one; 8-[5-(5,7-dihydroxy-4-oxochromen-2-yl)-2-hydroxyphenyl]-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one; 4,5,7-Trihydroxyflavone(3->8)-4,5,7-trihydroxyflavone; 8-(5-(5,7-dihydroxy-4-oxo-4H-chromen-2-yl)-2; 4,4,5,5,7,7-Hexahydroxy-3,8-biflavone, 8CI; 3,8-BIFLAVONE, 4,4,5,5,7,7-HEXAHYDROXY; (4-hydroxyphenyl)-4H-chromen-4-one; Amentoflavone, analytical standard; -hydroxyphenyl)-5,7-dihydroxy-2-; 3,8-Bi[4,5,7-trihydroxyflavone]; Amentoflavone, >=99.0\\% (HPLC); YUSWMAULDXZHPY-UHFFFAOYSA-N; Tridemethylsciadopitysin; GINKGETIN, DIDEMETHYL-; AMENTOFLAVONE [INCI]; Didemethyl-ginkgetin; I3,II8-BIAPIGENIN; UNII-9I1VC79L77; 3,8-Biapigenin; Amenthoflavone; MEGxp0_000924; Amentoflavone; Ametoflavone; 9I1VC79L77
数据库引用编号
21 个数据库交叉引用编号
- ChEBI: CHEBI:2631
- KEGG: C10018
- PubChem: 5281600
- HMDB: HMDB0030832
- Metlin: METLIN47521
- Wikipedia: Amentoflavone
- LipidMAPS: LMPK12040009
- MeSH: amentoflavone
- ChemIDplus: 0001617534
- KNApSAcK: C00042224
- KNApSAcK: C00001015
- foodb: FDB002788
- chemspider: 4444919
- CAS: 1617-53-4
- CAS: 1017-53-4
- medchemexpress: HY-N0662
- PMhub: MS000009521
- MetaboLights: MTBLC2631
- PubChem: 12204
- 3DMET: B03462
- NIKKAJI: J34.739F
分类词条
相关代谢途径
Reactome(0)
BioCyc(0)
PlantCyc(0)
代谢反应
0 个相关的代谢反应过程信息。
Reactome(0)
BioCyc(0)
WikiPathways(0)
Plant Reactome(0)
INOH(0)
PlantCyc(0)
COVID-19 Disease Map(0)
PathBank(0)
PharmGKB(0)
201 个相关的物种来源信息
- 165205 - Afrocarpus gracilior: 10.1016/S0031-9422(00)81743-4
- 3813 - Albizia julibrissin: 10.1248/CPB.60.129
- 992639 - Allophylus decipiens: 10.1016/0305-1978(85)90066-3
- 89479 - Amentotaxus yunnanensis: 10.1021/NP030117B
- 56994 - Araucaria cunninghamii: 10.1016/S0031-9422(00)91236-6
- 103964 - Austrocedrus chilensis:
- 1898900 - Biophytum sensitivum: 10.1055/S-2006-957455
- 172644 - Broussonetia papyrifera: 10.1021/NP800564Z
- 103962 - Callitris acuminata: 10.1016/0031-9422(83)85032-8
- 214234 - Callitris endlicheri: 10.1016/0031-9422(83)85032-8
- 214231 - Callitris macleayana: 10.1016/0031-9422(83)85032-8
- 2250721 - Callitris neocaledonica: 10.1016/0031-9422(83)85032-8
- 214236 - Callitris oblonga: 10.1016/0031-9422(83)85032-8
- 89193 - Callitris pancheri:
- 214228 - Callitris pyramidalis: 10.1016/0031-9422(83)85032-8
- 214232 - Callitris sulcata: 10.1016/0031-9422(83)85032-8
- 85954 - Callitropsis nootkatensis: 10.1016/S0031-9422(00)83535-9
- 13387 - Calocedrus decurrens:
- 54798 - Calocedrus formosana:
- 280748 - Calophyllum brasiliense:
- 883767 - Calophyllum calaba: 10.1016/S0031-9422(00)80326-X
- 158927 - Calophyllum inophyllum:
- 667336 - Calophyllum venulosum:
- 1321791 - Campylospermum flavum: 10.1016/J.PHYTOCHEM.2010.08.006
- 1501027 - Campylospermum glaucum: 10.1016/J.PHYTOCHEM.2008.04.013
- 1321793 - Campylospermum sulcatum:
- 533031 - Canarium schweinfurthii: 10.4314/BCSE.V14I2.71972
- 66169 - Cephalotaxus fortunei: 10.1021/NP030117B
- 58029 - Cephalotaxus harringtonia: 10.1039/P19810001389
- 187461 - Chamaecyparis formosensis:
- 58030 - Chamaecyparis lawsoniana: 10.1016/S0031-9422(00)83535-9
- 187463 - Chamaecyparis thyoides: 10.1016/S0031-9422(00)83535-9
- 316753 - Chrozophora tinctoria:
- 3369 - Cryptomeria japonica: 10.1248/CPB.31.919
- 28977 - Cunninghamia lanceolata: 10.1248/YAKUSHI1947.88.11_1489
- 187464 - Cupressus cashmeriana: 10.1021/NP50051A032
- 13469 - Cupressus sempervirens:
- 329091 - Cupressus torulosa: 10.1515/ZNC-1998-11-1202
- 329091 - Cupressus torulosa var. torulosa: 10.1515/ZNC-1998-11-1202
- 1115358 - Cycas beddomei: 10.1016/S0031-9422(97)00417-2
- 3397 - Cycas circinalis: 10.1055/S-0029-1240743
- 3396 - Cycas revoluta:
- 13497 - Diselma archeri: 10.1016/0031-9422(83)85032-8
- 212299 - Elateriospermum tapos: 10.1021/NP070629G
- 103972 - Fitzroya cupressoides: 10.1016/0031-9422(83)85032-8
- 231905 - Garcinia dulcis: 10.1177/1934578X1701200337
- 156481 - Garcinia intermedia: 10.1248/BPB.27.141
- 469930 - Garcinia kola:
- 469932 - Garcinia livingstonei:
- 180114 - Garcinia prainiana: 10.1139/V10-168
- 198766 - Garcinia xanthochymus:
- 3311 - Ginkgo biloba:
- 3311 - Ginkgo biloba L.: -
- 38724 - Haplopteris anguste-elongata: 10.1021/NP050060O
- 290962 - Hippobromus pauciflorus: 10.1021/NP50050A061
- 9606 - Homo sapiens: -
- 268978 - Hypericum balearicum: 10.1055/S-2006-957796
- 1136959 - Hypericum bithynicum: 10.1055/S-2006-957796
- 1321328 - Hypericum elegans: 10.1080/14786410802278327
- 336625 - Hypericum glandulosum: 10.1055/S-2006-957796
- 673928 - Hypericum hirsutum: 10.1055/S-2006-960798
- 269006 - Hypericum maculatum:
- 673929 - Hypericum montanum: 10.1055/S-2006-960798
- 282549 - Hypericum olympicum: 10.1055/S-2006-957796
- 65561 - Hypericum perforatum:
- 626749 - Hypericum tetrapterum: 10.1055/S-2006-960798
- 1321357 - Hypericum thasium: 10.1016/J.PHYTOCHEM.2008.10.006
- 1137039 - Hypericum tomentosum: 10.1055/S-2006-957796
- 49752 - Isophysis tasmanica: 10.1016/S0031-9422(00)83875-3
- 884032 - Juniperus bermudiana: 10.1016/S0031-9422(00)83535-9
- 714497 - Juniperus chinensis var. chinensis: 10.1248/CPB.50.1358
- 58039 - Juniperus communis:
- 103973 - Juniperus drupacea:
- 758917 - Juniperus excelsa: 10.1016/S0031-9422(00)83535-9
- 114265 - Juniperus occidentalis: 10.1248/CPB.50.1358
- 69008 - Juniperus oxycedrus: 10.1016/S0031-9422(00)83535-9
- 61308 - Juniperus phoenicea: 10.1016/S0031-9422(00)85693-9
- 62753 - Juniperus procera: 10.1016/S0031-9422(00)83535-9
- 99809 - Juniperus rigida: 10.1248/CPB.50.1358
- 39584 - Juniperus virginiana:
- 59087 - Lanaria lanata: 10.1021/NP50075A007
- 52835 - Leycesteria formosa: 10.1007/978-94-015-9572-8_3
- 103974 - Libocedrus bidwillii: 10.1016/0031-9422(90)85105-O
- 2250722 - Libocedrus chevalieri: 10.1016/0031-9422(90)85105-O
- 13595 - Libocedrus plumosa: 10.1016/0031-9422(83)85032-8
- 103975 - Libocedrus yateensis:
- 231913 - Mammea siamensis: 10.1016/J.BMCL.2012.10.127
- 29780 - Mangifera indica: 10.1016/S0031-9422(00)83042-3
- 3983 - Manihot esculenta: 10.1016/S0031-9422(00)86949-6
- 3371 - Metasequoia glyptostroboides: 10.1016/S0031-9422(00)89893-3
- 13614 - Microbiota decussata: 10.1515/ZNC-2002-11-1208
- 36012 - Nageia nagi: 10.1016/S0031-9422(00)81743-4
- 41776 - Nandina domestica: 10.1016/S0014-2999(99)00144-2
- 289733 - Orthopterygium huaucui: 10.1016/0031-9422(88)80019-0
- 1647914 - Ouratea castaneifolia: 10.1590/S0102-695X2009000600004
- 2364057 - Ouratea multiflora:
- 2699671 - Ouratea semiserrata:
- 103977 - Papuacedrus papuana: 10.1016/0031-9422(83)85032-8
- 122947 - Patersonia glabrata: 10.1515/ZNC-1985-5-608
- 141000 - Physocarpus capitatus: 10.1021/NP8005259
- 123602 - Picea smithiana: 10.1515/ZNC-1988-1-202
- 103979 - Pilgerodendron uviferum: 10.1016/0031-9422(83)85032-8
- 46836 - Pinus palustris: 10.1007/978-94-007-4053-2_38
- 1639866 - Piranhea mexicana:
- 33090 - Plants: -
- 58046 - Platycladus orientalis:
- 58046 - Platycladus orientalis (L.) Franco: -
- 1030195 - Podocarpus elongatus: 10.1016/S0031-9422(00)81743-4
- 120615 - Podocarpus fasciculus: 10.1248/CPB.56.585
- 120620 - Podocarpus latifolius: 10.1016/S0031-9422(00)81743-4
- 58043 - Podocarpus macrophyllus: 10.1248/CPB.28.1894
- 61307 - Podocarpus neriifolius:
- 120625 - Podocarpus nivalis: 10.1248/CPB.56.585
- 485824 - Prumnopitys montana: 10.1016/S0031-9422(00)81743-4
- 2029322 - Psilotum complanatum: 10.1016/0305-1978(90)90024-A
- 3240 - Psilotum nudum: 10.1016/0305-1978(90)90024-A
- 568684 - Quercus canariensis: 10.1007/978-94-007-4053-2_3
- 39470 - Quercus infectoria: 10.1007/978-94-007-4053-2_3
- 39471 - Quercus pubescens: 10.1007/978-94-007-4053-2_3
- 190404 - Retrophyllum rospigliosii: 10.1055/S-2007-990218
- 298661 - Rhus coriaria: 10.1007/BF02311521
- 298665 - Rhus punjabensis: 10.1007/S10600-015-1336-2
- 270266 - Schinus areira: 10.1016/0305-1978(85)90066-3
- 169191 - Schinus terebinthifolia: 10.1515/ZNB-1986-1125
- 28979 - Sciadopitys verticillata: 10.1515/ZNC-1998-11-1202
- 298681 - Searsia quartiniana: 10.1016/0305-1978(85)90066-3
- 289761 - Searsia undulata: 10.1016/0305-1978(85)90066-3
- 1353958 - Selaginella braunii:
- 417315 - Selaginella davidii:
- 1353961 - Selaginella delicatula:
- 50508 - Selaginella denticulata: 10.1515/ZNC-1994-3-417
- 186426 - Selaginella doederleinii:
- 186426 - Selaginella Doederleinii Hieron: -
- 81964 - Selaginella kraussiana: 10.1007/978-1-4615-3476-1_53
- 1353966 - Selaginella labordei: 10.1080/14786410802228736
- 88036 - Selaginella moellendorffii:
- 1715386 - Selaginella nothohybrida: 10.1016/J.JEP.2015.01.031
- 672198 - Selaginella pulvinata:
- 493175 - Selaginella sanguinolenta:
- 69996 - Selaginella selaginoides: 10.1515/ZNC-1994-3-416
- 137174 - Selaginella sinensis:
- 137175 - Selaginella stauntoniana:
- 137178 - Selaginella tamariscina:
- 307165 - Selaginella uncinata:
- 137179 - Selaginella willdenowii: 10.1016/0031-9422(95)00212-P
- 99814 - Sequoiadendron giganteum: 10.1515/ZNC-1998-11-1202
- 50187 - Taiwania cryptomerioides: 10.1039/P19810000553
- 28982 - Taxodium distichum: 10.1016/0031-9422(73)80042-1
- 25629 - Taxus baccata:
- 99806 - Taxus cuspidata: 10.1515/ZNC-1998-11-1202
- 147273 - Taxus wallichiana:
- 13717 - Tetraclinis articulata: 10.1016/0031-9422(83)85032-8
- 241616 - Thuja koraiensis: 10.1016/S0031-9422(00)83535-9
- 3317 - Thuja occidentalis: 10.1016/S0031-9422(00)83535-9
- 3316 - Thuja plicata:
- 89194 - Thuja standishii: 10.1016/S0031-9422(00)83535-9
- 13727 - Thujopsis dolabrata: 10.1016/S0031-9422(00)83535-9
- 121718 - Tilia tomentosa: 10.1016/0378-8741(94)90098-1
- 147460 - Torreya fargesii var. yunnanensis: 10.1021/NP030117B
- 58047 - Torreya grandis: 10.1021/NP030117B
- 50189 - Torreya nucifera:
- 269721 - Toxicodendron succedaneum:
- 269721 - Toxicodendron succedaneum [Syn. Rhus succedanea ]: -
- 226819 - Trogopterus xanthipes: 10.1080/14786419.2010.482057
- 224736 - Viburnum betulifolium: 10.1016/S0031-9422(98)00681-5
- 1190426 - Viburnum buddleifolium: 10.1016/S0031-9422(98)00681-5
- 1190427 - Viburnum burejaeticum: 10.1016/S0031-9422(98)00681-5
- 237927 - Viburnum carlesii: 10.1016/S0031-9422(98)00681-5
- 237928 - Viburnum cinnamomifolium: 10.1016/S0031-9422(98)00681-5
- 1127644 - Viburnum coriaceum: 10.1016/S0031-9422(00)82372-9
- 446156 - Viburnum cotinifolium:
- 237931 - Viburnum cylindricum:
- 237932 - Viburnum davidii: 10.1016/S0031-9422(98)00681-5
- 61589 - Viburnum dentatum: 10.1016/S0031-9422(98)00681-5
- 237939 - Viburnum farreri: 10.1016/S0031-9422(98)00681-5
- 1444319 - Viburnum foetens: 10.1016/S0031-9422(98)00681-5
- 1190434 - Viburnum glomeratum: 10.1016/S0031-9422(98)00681-5
- 1444320 - Viburnum grandiflorum: 10.1016/S0031-9422(98)00681-5
- 1444321 - Viburnum henryi: 10.1016/S0031-9422(98)00681-5
- 237943 - Viburnum jucundum: 10.1055/S-2001-17357
- 237945 - Viburnum lantana: 10.1016/S0031-9422(98)00681-5
- 61590 - Viburnum lentago: 10.1016/S0031-9422(98)00681-5
- 237950 - Viburnum nudum: 10.1016/S0031-9422(98)00681-5
- 237951 - Viburnum odoratissimum: 10.1016/S0031-9422(98)00681-5
- 85293 - Viburnum opulus:
- 432678 - Viburnum orientale: 10.1016/S0031-9422(98)00681-5
- 1190442 - Viburnum pichinchense: 10.1016/S0305-1978(02)00078-9
- 179996 - Viburnum plicatum: 10.1016/S0031-9422(98)00681-5
- 432679 - Viburnum propinquum: 10.1016/S0031-9422(98)00681-5
- 237954 - Viburnum prunifolium: 10.1016/S0031-9422(98)00681-5
- 47689 - Viburnum rhytidophyllum: 10.1016/S0031-9422(98)00681-5
- 436501 - Viburnum setigerum: 10.1016/S0031-9422(98)00681-5
- 61591 - Viburnum sieboldii: 10.1016/S0031-9422(98)00681-5
- 237958 - Viburnum suspensum: 10.1016/S0031-9422(98)00681-5
- 237959 - Viburnum tinus: 10.1016/S0031-9422(98)00681-5
- 237963 - Viburnum utile: 10.1016/S0031-9422(98)00681-5
- 13760 - Widdringtonia cedarbergensis: 10.1016/0031-9422(83)85032-8
- 214229 - Widdringtonia nodiflora: 10.1016/0031-9422(83)85032-8
- 1075059 - Widdringtonia whytei: 10.1016/0031-9422(83)85032-8
- 58046 - 侧柏叶: -
- 33090 - 卷柏: -
在这里通过桑基图来展示出与当前的这个代谢物在我们的BioDeep知识库中具有相关联信息的其他代谢物。在这里进行关联的信息来源主要有:
- PubMed: 来源于PubMed文献库中的文献信息,我们通过自然语言数据挖掘得到的在同一篇文献中被同时提及的相关代谢物列表,这个列表按照代谢物同时出现的文献数量降序排序,取前10个代谢物作为相关研究中关联性很高的代谢物集合展示在桑基图中。
- NCBI Taxonomy: 通过文献数据挖掘,得到的代谢物物种来源信息关联。这个关联信息同样按照出现的次数降序排序,取前10个代谢物作为高关联度的代谢物集合展示在桑吉图上。
- Chemical Taxonomy: 在物质分类上处于同一个分类集合中的其他代谢物
- Chemical Reaction: 在化学反应过程中,存在为当前代谢物相关联的生化反应过程中的反应底物或者反应产物的关联代谢物信息。
点击图上的相关代谢物的名称,可以跳转到相关代谢物的信息页面。
文献列表
- Chie Aoki-Utsubo, Puguh Indrasetiawan, Kento Fukano, Masamichi Muramatsu, Nina Artanti, Muhammad Hanafi, Hak Hotta, Masanori Kameoka. Amentoflavone inhibits hepatitis B virus infection via the suppression of preS1 binding to host cells.
Microbiology and immunology.
2023 Mar; ?(?):. doi:
10.1111/1348-0421.13064
. [PMID: 36929353] - Hardeep Singh Tuli, Hemant Joshi, Kanupriya Vashishth, Seema Ramniwas, Mehmet Varol, Manoj Kumar, Isha Rani, Vibha Rani, Katrin Sak. Chemopreventive mechanisms of amentoflavone: recent trends and advancements.
Naunyn-Schmiedeberg's archives of pharmacology.
2023 Feb; ?(?):. doi:
10.1007/s00210-023-02416-6
. [PMID: 36773053] - Wang Tingting, Fang Tianqi, Wang Xinyu, Zhang Can, Shen Xue, Deng Xuming, Wang Jianfeng. Amentoflavone attenuates Listeria monocytogenes pathogenicity through an LLO-dependent mechanism.
British journal of pharmacology.
2022 07; 179(14):3839-3858. doi:
10.1111/bph.15827
. [PMID: 35229287] - Dipta Dey, Rajib Hossain, Partha Biswas, Priyanka Paul, Md Aminul Islam, Tanzila Ismail Ema, Bibhuti Kumar Gain, Mohammad Mehedi Hasan, Shabana Bibi, Muhammad Torequl Islam, Md Ataur Rahman, Bonglee Kim. Amentoflavone derivatives significantly act towards the main protease (3CLPRO/MPRO) of SARS-CoV-2: in silico admet profiling, molecular docking, molecular dynamics simulation, network pharmacology.
Molecular diversity.
2022 May; ?(?):. doi:
10.1007/s11030-022-10459-9
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