Showing entry for Tomentic Acid



                             
General Compound Information
BXGC IdBXGC0034601
Compound NameTomentic Acid
Structure
FormulaC30H48O5
InchiKeyOXVUXGFZHDKYLS-BLIWDXROSA-N
SMILESO[C@@H]1C[C@@]2(C)[C@H](C([C@H]1O)(C)C)CC[C@@]1([C@@H]2CC=C2[C@@]1(C)CC[C@@]1([C@H]2[C@](C)(O)[C@H](C)CC1)C(=O)O)C
InchiInChI=1S/C30H48O5/c1-17-10-13-30(24(33)34)15-14-27(5)18(22(30)29(17,7)35)8-9-21-26(4)16-19(31)23(32)25(2,3)20(26)11-12-28(21,27)6/h8,17,19-23,31-32,35H,9-16H2,1-7H3,(H,33,34)/t17-,19-,20+,21-,22-,23+,26+,27-,28-,29-,30+/m1/s1
IUPAC(1R,2R,4aS,6aR,6aS,6bR,8aR,10R,11R,12aR,14bS)-1,10,11-trihydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
Molecular Weight488.35
Pubchem Id73193
Chembl IdCHEMBL239077
Targets of Information Source
DrugBank n.a
Uniport Id BXGT Id Protein Name Status Protein Class Gene Groups Target Type
Uniport Id BXGT Id Protein Name Status Protein Class Gene Groups Target Type
PDB n.a
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM Ka M-1
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM Ka M-1
Binding DB n.a
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM EC50 nM
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM EC50 nM
CHEMBL CHEMBL239077
Uniport Id BXGT Id Protein Name Status Protein Class Gene width="10%">Type Relation value Units
Uniport Id BXGT Id Protein Name Status Protein Class Gene Type Relation value Units
Q9YQ12 BXGT022394 Protease unreviewed - protease Inhibition '=' 49 %
P28845 BXGT009297 Corticosteroid 11-beta-dehydrogenase isozyme 1 reviewed - HSD11B1 IC50 - - -
P80365 BXGT011895 Corticosteroid 11-beta-dehydrogenase isozyme 2 reviewed Enzyme HSD11B2 Activity - - -
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF00076 Loquat Eriobotrya japonica Fruits
BXGF00959 Artemisia hanseniana Artemisia hanseniana Others
BXGF01110 Eucalyptus coccifera Eucalyptus coccifera Others
BXGF01134 Arnebia euchroma Arnebia euchroma Medicinal Plant
BXGF01159 Kopsia grandifolia Kopsia grandifolia Others
BXGF01230 Lithospermum erythrorhizon Lithospermum erythrorhizon Medicinal Plant
BXGF01281 Ledebouria socialis Ledebouria socialis Others
BXGF01361 Lycopus europaeus Lycopus europaeus Medicinal Plant
BXGF01383 Dipodium punctatum Dipodium punctatum Others
BXGF01400 Dipterocarpus dyeri Dipterocarpus dyeri Others
BXGF01518 Ipomoea cairica Ipomoea cairica Medicinal Plant
BXGF01672 Zanthoxylum brachyacanthum Zanthoxylum brachyacanthum Medicinal Plant
BXGF01693 Psittacanthus cucullaris Psittacanthus cucullaris Others
BXGF01699 Ceanothus velutinus Ceanothus velutinus Medicinal Plant
BXGF01701 Polygala amarella Polygala amarella Medicinal Plant
BXGF01732 Garcinia scortechinii Garcinia scortechinii Others
BXGF01756 Apollonias barbujana Apollonias barbujana Others
BXGF01770 Clutia richardiana Clutia richardiana Others
BXGF01781 Chlorophytum borivilianum Chlorophytum borivilianum Medicinal Plant
BXGF01959 Cissus quinquefolia Cissus quinquefolia Others
BXGF02170 Berberis brandisiana Berberis brandisiana Others
BXGF02316 Isodon lophanthoides Isodon lophanthoides Medicinal Plant
BXGF02338 Knoxia valerianoides Knoxia valerianoides Medicinal Plant
BXGF02357 Euodia bodinieri Euodia bodinieri Others
BXGF02416 Melaleuca genistifolia Melaleuca genistifolia Others
BXGF02481 Prunella vulgaris Prunella vulgaris Medicinal Plant
BXGF02596 Fragaria vesca Fragaria vesca Medicinal Plant
BXGF02604 Agrimonia pilosa Agrimonia pilosa Medicinal Plant
BXGF02611 Geranium nepalense Geranium nepalense Medicinal Plant
BXGF02711 Ligularia dentata Ligularia dentata Medicinal Plant
BXGF02780 Eria robusta Eria robusta Others
BXGF02842 Euphorbia franckiana Euphorbia franckiana Others
BXGF02945 Pyracantha coccinea Pyracantha coccinea Medicinal Plant
BXGF02978 Tetradium ruticarpum Tetradium ruticarpum Medicinal Plant
BXGF02998 Uncaria gambier Uncaria gambier Medicinal Plant
BXGF03090 Lasianthus fordii Lasianthus fordii Others
BXGF03243 Elsholtzia ciliata Elsholtzia ciliata Medicinal Plant
BXGF03341 Lycopus lucidus Lycopus lucidus Medicinal Plant
BXGF03471 Kippistia suaedifolia Kippistia suaedifolia Others
BXGF03520 Echinops setifer Echinops setifer Medicinal Plant
BXGF03635 Hertia intermedia Hertia intermedia Others
BXGF03718 Swertia angustifolia Swertia angustifolia Medicinal Plant
BXGF03767 Pelargonium reniforme Pelargonium reniforme Medicinal Plant
BXGF03824 Haplopappus ciliatus Haplopappus ciliatus Others
BXGF04278 Casimiroa tetrameria Casimiroa tetrameria Medicinal Plant
BXGF04292 Bowdichia virgilioides Bowdichia virgilioides Medicinal Plant
BXGF04634 Pygeum topengii Pygeum topengii Others
BXGF04715 Rhaponticum uniflorum Rhaponticum uniflorum Medicinal Plant
BXGF04886 Boehmeria nivea Boehmeria nivea Medicinal Plant
BXGF04997 Geum japonicum Geum japonicum Medicinal Plant
BXGF05096 Aconitum leucostomum Aconitum leucostomum Medicinal Plant
BXGF05118 Euscaphis japonica Euscaphis japonica Medicinal Plant
BXGF05169 Senecio sinuatus Senecio sinuatus Others
BXGF05200 Aquilegia ecalcarata Aquilegia ecalcarata Medicinal Plant
BXGF05230 Echinopsis latifolius Echinopsis latifolius Others
BXGF05316 Persea mexicana Persea mexicana Others
BXGF05348 Colchicum speciosum Colchicum speciosum Others
BXGF05356 Euodia officinalis Euodia officinalis Others
BXGF05462 Campsis flos Campsis flos Others
BXGF05531 Relbunium atherodes Relbunium atherodes Others
BXGF05767 Gardenia tubifera Gardenia tubifera Medicinal Plant
BXGF05831 Rosa laevigata Rosa laevigata Medicinal Plant
BXGF05845 Panax innovans Panax innovans Others
BXGF05937 Diphasiastrum alpinum Diphasiastrum alpinum Others
BXGF05956 Blumea mollis Blumea mollis Medicinal Plant
BXGF06002 Euodia ruticarpa Euodia ruticarpa Others
BXGF06070 Perilla frutescens Perilla frutescens Medicinal Plant
BXGF06175 Rhizomnium magnifolium Rhizomnium magnifolium Others
BXGF06213 Heliomeris multiflora Heliomeris multiflora Others
BXGF06257 Rosa multiflora Rosa multiflora Medicinal Plant
The  compound-realted  diseases
Diseases
BXGD Id Disease Name CUI Disease Id Disease Class Name Number of targets?Number of targets related to compound connecting disease, higher numbers indicate the compound is more associated with the disease