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Dioscin, Antagonist of CXCR3Cas#: 19057-60-4 Compound CID: 119245Formula: C45H72O16 Molecular Weight: 869.05IUPAC Name: (2S,3R,4R,5R,6S)-2-[(2R,3S,4S,5R,6R)-4-hydroxy-2-(hydroxymethyl)-6-[(1S,2S,4S,5'R,6R,7S,8R,9S,12S,13R,16S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-yl]oxy-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxy-6-methyloxane-3,4,5-triolSMILES: CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CC=C6C5(CCC(C6)OC7C(C(C(C(O7)CO)OC8C(C(C(C(O8)C)O)O)O)O)OC9C(C(C(C(O9)C)O)O)O)C)C)C)OC1InChIKey: VNONINPVFQTJOC-ZGXDEBHDSA-NInChI: InChI=1S/C45H72O16/c1-19-9-14-45(54-18-19)20(2)30-28(61-45)16-27-25-8-7-23-15-24(10-12-43(23,5)26(25)11-13-44(27,30)6)57-42-39(60-41-36(52)34(50)32(48)22(4)56-41)37(53)38(29(17-46)58-42)59-40-35(51)33(49)31(47)21(3)55-40/h7,19-22,24-42,46-53H,8-18H2,1-6H3/t19-,20+,21+,22+,24+,25-,26+,27+,28+,29-,30+,31+,32+,33-,34-,35-,36-,37+,38-,39-,40+,41+,42-,43+,44+,45-/m1/s1Synonyms: UNII-3B95U4OLWV | 3-O-beta-D-alpha-L-Rhamnopyranosyl(1->4)-[alpha-L-rhamnopyranosyl(1->2)]-beta-D-glucopyranoside-dio...
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6-Propyl-2-thiouracil, Thyroid peroxidase inhibitorCas#: 51-52-5 Compound CID: 657298Formula: C7H10N2OS Molecular Weight: 170.23IUPAC Name: 6-propyl-2-sulfanylidene-1H-pyrimidin-4-oneSMILES: CCCC1=CC(=O)NC(=S)N1InChIKey: KNAHARQHSZJURB-UHFFFAOYSA-NInChI: InChI=1S/C7H10N2OS/c1-2-3-5-4-6(10)9-7(11)8-5/h4H,2-3H2,1H3,(H2,8,9,10,11)Synonyms: BSPBio_000387 | PROPYLTHIOURACIL [IARC] | PROPYLTHIOURACIL [EP MONOGRAPH] | Propylthiouracil; 2,3-dihydro-6-propyl-2-...
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8-Methoxypsoralen, Agonist of TAS2R20Cas#: 298-81-7 Compound CID: 4114Formula: C12H8O4 Molecular Weight: 216.19IUPAC Name: 9-methoxyfuro[3,2-g]chromen-7-oneSMILES: COC1=C2C(=CC3=C1OC=C3)C=CC(=O)O2InChIKey: QXKHYNVANLEOEG-UHFFFAOYSA-NInChI: InChI=1S/C12H8O4/c1-14-12-10-8(4-5-15-10)6-7-2-3-9(13)16-11(7)12/h2-6H,1H3Synonyms: 8-MOP | 9-METHOXY-2H-FURO[3,2-G]CHROMEN-2-ONE | 9-Methoxy-7H-furo(3,2-g)benzopyran-7-one | 9-Methoxy-7H-furo[3,2-g]ch...
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PsoralenCas#: 66-97-7 Compound CID: 6199Formula: C11H6NO3 Molecular Weight: 186.16IUPAC Name: furo[3,2-g]chromen-7-oneSMILES: C1=CC(=O)OC2=CC3=C(C=CO3)C=C21InChIKey: ZCCUUQDIBDJBTK-UHFFFAOYSA-NInChI: InChI=1S/C11H6O3/c12-11-2-1-7-5-8-3-4-13-9(8)6-10(7)14-11/h1-6HSynonyms: 7H-Furo(3,2-g)(1)benzopyran-7-one | BRD-K47264279-001-01-4 | DTXSID00216205 | 6-hydroxy-5-benzofuranacrylic Acid deta...
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DioscinCas#: 19057-60-4 Compound CID: 119245Formula: C45H72O16 Molecular Weight: 869.05IUPAC Name: (2S,3R,4R,5R,6S)-2-[(2R,3S,4S,5R,6R)-4-hydroxy-2-(hydroxymethyl)-6-[(1S,2S,4S,5'R,6R,7S,8R,9S,12S,13R,16S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-yl]oxy-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxy-6-methyloxane-3,4,5-triolSMILES: CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CC=C6C5(CCC(C6)OC7C(C(C(C(O7)CO)OC8C(C(C(C(O8)C)O)O)O)O)OC9C(C(C(C(O9)C)O)O)O)C)C)C)OC1InChIKey: VNONINPVFQTJOC-ZGXDEBHDSA-NInChI: InChI=1S/C45H72O16/c1-19-9-14-45(54-18-19)20(2)30-28(61-45)16-27-25-8-7-23-15-24(10-12-43(23,5)26(25)11-13-44(27,30)6)57-42-39(60-41-36(52)34(50)32(48)22(4)56-41)37(53)38(29(17-46)58-42)59-40-35(51)33(49)31(47)21(3)55-40/h7,19-22,24-42,46-53H,8-18H2,1-6H3/t19-,20+,21+,22+,24+,25-,26+,27+,28+,29-,30+,31+,32+,33-,34-,35-,36-,37+,38-,39-,40+,41+,42-,43+,44+,45-/m1/s1Synonyms: UNII-3B95U4OLWV | 3-O-beta-D-alpha-L-Rhamnopyranosyl(1->4)-[alpha-L-rhamnopyranosyl(1->2)]-beta-D-glucopyranoside-dio...
