CASEINECSJRC CODEChemical NameSMILES
103-90-2203-157-5Acetaminophenc1(ccc(cc1)O)NC(=O)C
10540-29-1234-118-0TamoxifenC(=C(/c1ccccc1)CC)(\c1ccc(OCCN(C)C)cc1)c1ccccc1
107-18-6203-470-7Allyl AlcoholOCC=C
113558-89-7-E-4031c1(nc(CCN2CCC(CC2)C(c2ccc(cc2)NS(C)(=O)=O)=O)ccc1)C
1162-65-8214-603-3Aflatoxin B1COc1cc2OC3OC=CC3c2c4OC(=O)C5=C(CCC5=O)c14
144-48-9205-630-1IodoacetamideNC(=O)CI
157212-55-0-Bosentanc1c(c(ccc1)OC)Oc1c(OCCO)nc(c2ncccn2)nc1NS(c1ccc(C(C)(C)C)cc1)(=O)=O.O
1951-25-3217-772-1AmiodaroneCCCCc1oc2ccccc2c1C(=O)c3cc(I)c(OCCN(CC)CC)c(I)c3
23214-92-8245-495-6DoxorubicinCOc1cccc2C(=O)c3c(O)c4C[C@](O)(C[C@H](O[C@H]5C[C@H](N)[C@H](O)[C@H](C)O5)c4c(O)c3C(=O)c12)C(=O)CO
31282-04-9250-545-5Hygromycin BCN[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@@H]3OC4(O[C@H](C(N)CO)[C@H](O)[C@H](O)[C@H]4O)O[C@H]23)[C@@H]1O
481658-94-0-Dirlotapidec1c(ccc2n(c(cc12)C(N[C@@H](C(N(Cc1ccccc1)C)=O)c1ccccc1)=O)C)NC(c1ccccc1c1ccc(cc1)C(F)(F)F)=O
50-53-3200-045-8ChlorpromazineCN(C)CCCN1C2=CC=CC=C2SC2=C1C=C(Cl)C=C2
51-83-2200-127-3CarbacholC[N+](C)(C)CCOC(=O)N.[Cl-]
54910-89-3611-209-7FluoxetineCNCCC(Oc1ccc(cc1)C(F)(F)F)c2ccccc2
56-23-5200-262-8Carbon TetrachlorideClC(Cl)(Cl)Cl
59-05-2200-413-8MethotrexateCN(Cc1cnc2nc(N)nc(N)c2n1)c3ccc(cc3)C(=O)N[C@H](CCC(O)=O)C(O)=O
6956-96-3-Dimethoxy-naphthoquinone (DMNQ)C1(=C(C(c2ccccc2C1=O)=O)OC)OC
83-79-4201-501-9RotenoneCOc1cc2OC[C@H]3Oc4c5C[C@@H](Oc5ccc4C(=O)[C@H]3c2cc1OC)C(=C)C
99-66-1202-777-3Valproic AcidC(CCC)(CCC)C(O)=O