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Glycyrrhizic acid, Inhibitor of OATP1B1;Inhibitor of OATP1B3Cas#: 1405-86-3 Compound CID: 14982Formula: C42H62O16 Molecular Weight: 822.93IUPAC Name: (2S,3S,4S,5R,6R)-6-[(2S,3R,4S,5S,6S)-2-[[(3S,4aR,6aR,6bS,8aS,11S,12aR,14aR,14bS)-11-carboxy-4,4,6a,6b,8a,11,14b-heptamethyl-14-oxo-2,3,4a,5,6,7,8,9,10,12,12a,14a-dodecahydro-1H-picen-3-yl]oxy]-6-carboxy-4,5-dihydroxyoxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acidSMILES: CC1(C2CCC3(C(C2(CCC1OC4C(C(C(C(O4)C(=O)O)O)O)OC5C(C(C(C(O5)C(=O)O)O)O)O)C)C(=O)C=C6C3(CCC7(C6CC(CC7)(C)C(=O)O)C)C)C)CInChIKey: LPLVUJXQOOQHMX-QWBHMCJMSA-NInChI: InChI=1S/C42H62O16/c1-37(2)21-8-11-42(7)31(20(43)16-18-19-17-39(4,36(53)54)13-12-38(19,3)14-15-41(18,42)6)40(21,5)10-9-22(37)55-35-30(26(47)25(46)29(57-35)33(51)52)58-34-27(48)23(44)24(45)28(56-34)32(49)50/h16,19,21-31,34-35,44-48H,8-15,17H2,1-7H3,(H,49,50)(H,51,52)(H,53,54)/t19-,21-,22-,23-,24-,25-,26-,27+,28-,29-,30+,31+,34-,35-,38+,39-,40-,41+,42+/m0/s1Synonyms: (3.BETA.,20.BETA.)-20-CARBOXY-11-OXO-30-NOROLEAN-12-EN-3-YL 2-O-.BETA.-D-GLUCOPYRANURONOSYL-.ALPHA.-D-GLUCOPYRANOSIDU...
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ColchicineCas#: 64-86-8 Compound CID: 6167Formula: C22H25NO6 Molecular Weight: 399.44IUPAC Name: N-[(7S)-1,2,3,10-tetramethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamideSMILES: CC(=O)NC1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)OC)OC)OC)OCInChIKey: IAKHMKGGTNLKSZ-INIZCTEOSA-NInChI: InChI=1S/C22H25NO6/c1-12(24)23-16-8-6-13-10-19(27-3)21(28-4)22(29-5)20(13)14-7-9-18(26-2)17(25)11-15(14)16/h7,9-11,16H,6,8H2,1-5H3,(H,23,24)/t16-/m0/s1Synonyms: COLBENEMID COMPONENT COLCHICINE | Colchicin | COLCHICINE [MI] | EINECS 200-598-5 | HSDB 3044 | COLCHICINE [HSDB] | CO...
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AllocryptopineCas#: 485-91-6 Compound CID: 98570Formula: C21H23NO5 Molecular Weight: 369.41IUPAC Name: 7,8-dimethoxy-11-methyl-17,19-dioxa-11-azatetracyclo[12.7.0.04,9.016,20]henicosa-1(21),4(9),5,7,14,16(20)-hexaen-2-oneSMILES: CN1CCC2=CC3=C(C=C2C(=O)CC4=C(C1)C(=C(C=C4)OC)OC)OCO3InChIKey: HYBRYAPKQCZIAE-UHFFFAOYSA-NInChI: InChI=1S/C21H23NO5/c1-22-7-6-14-9-19-20(27-12-26-19)10-15(14)17(23)8-13-4-5-18(24-2)21(25-3)16(13)11-22/h4-5,9-10H,6-8,11-12H2,1-3H3Synonyms: beta-Allocryptopine | EK27J8ROYB | HYBRYAPKQCZIAE-UHFFFAOYSA-N | NSC 404531 | SMR000283023 | 5,7,8,15-Tetrahydro-3,4-...
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GramineCas#: 87-52-5 Compound CID: 6890Formula: C11H14N2 Molecular Weight: 174.24IUPAC Name: 1-(1H-indol-3-yl)-N,N-dimethylmethanamineSMILES: CN(C)CC1=CNC2=CC=CC=C21InChIKey: OCDGBSUVYYVKQZ-UHFFFAOYSA-NInChI: InChI=1S/C11H14N2/c1-13(2)8-9-7-12-11-6-4-3-5-10(9)11/h3-7,12H,8H2,1-2H3Synonyms: A842252 | BRD-K26005076-001-03-7 | BSPBio_000598 | NCGC00016343-03 | TNP00029 | CAS-87-52-5 | FGQ8A78L14 | SCHEMBL635...
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Chlorpromazine hydrochloride, D2-like dopamine receptor antagonistCas#: 69-09-0 Compound CID: 6240Formula: C17H19ClN2S·HCl Molecular Weight: 355.33IUPAC Name: 3-(2-chlorophenothiazin-10-yl)-N,N-dimethylpropan-1-amine;hydrochlorideSMILES: CN(C)CCCN1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl.ClInChIKey: FBSMERQALIEGJT-UHFFFAOYSA-NInChI: InChI=1S/C17H19ClN2S.ClH/c1-19(2)10-5-11-20-14-6-3-4-7-16(14)21-17-9-8-13(18)12-15(17)20;/h3-4,6-9,12H,5,10-11H2,1-2H3;1HSynonyms: CPZ | Chlorpromazine.HCl | Largaktyl | Marazine | NC00552 | Chloropromazine monohydrochloride | Chlorpromazin-d6 hydr...
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Colchicine, Inhibitor of bromodomain containing 4;Antagonist of glycine receptor α1 subunit;Antagonist of glycine receptor α2 subunit;Agonist of TAS2R46;Agonist of TAS2R4;Inhibitor of tubulin beta class ICas#: 64-86-8 Compound CID: 6167Formula: C22H25NO6 Molecular Weight: 399.44IUPAC Name: N-[(7S)-1,2,3,10-tetramethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamideSMILES: CC(=O)NC1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)OC)OC)OC)OCInChIKey: IAKHMKGGTNLKSZ-INIZCTEOSA-NInChI: InChI=1S/C22H25NO6/c1-12(24)23-16-8-6-13-10-19(27-3)21(28-4)22(29-5)20(13)14-7-9-18(26-2)17(25)11-15(14)16/h7,9-11,16H,6,8H2,1-5H3,(H,23,24)/t16-/m0/s1Synonyms: colchicine|64-86-8|Colchisol|Colchineos|Colcin|Colchicinum|Colchicin|Colchicina|Condylon|Colsaloid|Colcrys|7alphaH-Co...
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Glycyrrhizic acid, Inhibitor of OATP1B1;Inhibitor of OATP1B3Cas#: 1405-86-3 Compound CID: 14982Formula: C42H62O16 Molecular Weight: 822.93IUPAC Name: (2S,3S,4S,5R,6R)-6-[(2S,3R,4S,5S,6S)-2-[[(3S,4aR,6aR,6bS,8aS,11S,12aR,14aR,14bS)-11-carboxy-4,4,6a,6b,8a,11,14b-heptamethyl-14-oxo-2,3,4a,5,6,7,8,9,10,12,12a,14a-dodecahydro-1H-picen-3-yl]oxy]-6-carboxy-4,5-dihydroxyoxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acidSMILES: CC1(C2CCC3(C(C2(CCC1OC4C(C(C(C(O4)C(=O)O)O)O)OC5C(C(C(C(O5)C(=O)O)O)O)O)C)C(=O)C=C6C3(CCC7(C6CC(CC7)(C)C(=O)O)C)C)C)CInChIKey: LPLVUJXQOOQHMX-QWBHMCJMSA-NInChI: InChI=1S/C42H62O16/c1-37(2)21-8-11-42(7)31(20(43)16-18-19-17-39(4,36(53)54)13-12-38(19,3)14-15-41(18,42)6)40(21,5)10-9-22(37)55-35-30(26(47)25(46)29(57-35)33(51)52)58-34-27(48)23(44)24(45)28(56-34)32(49)50/h16,19,21-31,34-35,44-48H,8-15,17H2,1-7H3,(H,49,50)(H,51,52)(H,53,54)/t19-,21-,22-,23-,24-,25-,26-,27+,28-,29-,30+,31+,34-,35-,38+,39-,40-,41+,42+/m0/s1Synonyms: Glycyrrhizic acid|glycyrrhizin|1405-86-3|Glycyrrhizinic acid|Glycyron|Glycyrrhetinic acid glycoside|potenlini|Glizige...
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Oleic acid, Agonist of FFA1 receptor;Agonist of FFA4 receptor;Activator of PLD2Cas#: 112-80-1 Compound CID: 445639Formula: CH3(CH2)7CH=CH(CH2)7COOH Molecular Weight: 282.46IUPAC Name: (Z)-octadec-9-enoic acidSMILES: CCCCCCCCC=CCCCCCCCC(=O)OInChIKey: ZQPPMHVWECSIRJ-KTKRTIGZSA-NInChI: InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10H,2-8,11-17H2,1H3,(H,19,20)/b10-9-Synonyms: C18:1 | HSDB 1240 | Elainic acid | Pamolyn | Priolene 6936 | K 52 | Emersol 220 white oleic acid | OLEICACID | UNII-2...
