94 SMILES Strings for Polyketide synthase Pks13

Compound Name
SMILES String
CCOC(=O)c1c2c(ccc(c2CN3CCC(CC3)C)O)oc1c4ccccc4
CNC(=O)c1c(oc2ccc(O)c(CN3CCCCC3)c12)-c1ccc(O)cc1
CNC(=O)c1c(oc2ccc(O)c(CN3CCCC3)c12)-c1ccc(O)cc1
CNC(=O)c1c(oc2ccc(O)c(CN3CCC3)c12)-c1ccc(O)cc1
CNC(=O)c1c(oc2ccc(O)c(CN3CCC[C@@H](O)C3)c12)-c1ccc(O)cc1 |r|
CNC(=O)c1c(oc2ccc(O)c(CNCC3(O)CC3)c12)-c1ccc(O)cc1
CNC(=O)c1c(oc2ccc(O)c(CN3CCC4(COC4)C3)c12)-c1ccc(O)cc1
CNC(=O)c1c(oc2ccc(O)c(CN3CC4(CCO4)C3)c12)-c1ccc(O)cc1
CNC(=O)c1c(oc2ccc(O)c(CN3CC4(COC4)C3)c12)-c1ccc(O)cc1
CNC(=O)c1c(oc2ccc(O)c(CN3CCC4(CCO4)C3)c12)-c1ccc(O)cc1
CNC(=O)c1c(oc2ccc(O)c(CN3CC4(C3)CCOC4)c12)-c1ccc(O)cc1
CNC(=O)c1c(oc2ccc(O)c(CN3CCCC(F)(F)C3)c12)-c1ccc(O)cc1
CNC(=O)c1c(oc2ccc(O)c(CN3CCC(F)CC3)c12)-c1ccc(O)cc1
CN(C)C(=O)c1c(oc2ccc(O)c(CN3CCC4(COC4)C3)c12)-c1ccc(O)cc1
Oc1ccc(cc1)-c1oc2ccc(O)c(CN3CCC4(COC4)C3)c2c1C(=O)N1CCC1
Oc1ccc(cc1)-c1oc2ccc(O)c(CN3CCC4(COC4)C3)c2c1C(=O)N1CC(F)C1
CC(=O)c1c(oc2ccc(O)c(CN3CCC4(COC4)C3)c12)-c1ccc(O)cc1
Oc1ccc(cc1)-c1cc2c(CN3CCC4(COC4)C3)c(O)ccc2o1
CNC(=O)c1c(oc2ccc(O)c(CN3CCC4(COC4)C3)c12)-c1ccccc1
CNC(=O)c1c(oc2ccc(O)c(CN3CCC4(COC4)C3)c12)-c1cccc(O)c1
CNC(=O)c1c(oc2ccc(O)c(CN3CCC4(COC4)C3)c12)-c1ccc(CO)cc1
CNC(=O)c1c(oc2ccc(O)c(CN3CCC4(COC4)C3)c12)-c1ccc(OC)cc1
CNC(=O)c1c(oc2ccc(O)c(CN3CCC4(COC4)C3)c12)-c1ccc2[nH]ccc2c1
CNC(=O)c1c(oc2ccc(O)c(CN3CCC4(COC4)C3)c12)-c1ccc(O)cn1
CNC(=O)c1c(oc2ccc(O)c(CN3CCC4(COC4)C3)c12)-c1ccc(O)c(F)c1
CNC(=O)c1c(oc2ccc(O)c(CN3CCC4(COC4)C3)c12)-c1ccc(O)cc1F
CNC(=O)c1c(oc2ccc(O)c(CN3CCC4(COC4)C3)c12)-c1c(F)cc(O)cc1F |(36.94,-34.48,;36.47,-35.95,;34.96,-36.27,;33.93,-35.13,;34.49,-37.73,;35.4,-38.99,;34.6,-40.02,;33.01,-39.76,;31.68,-40.53,;30.34,-39.76,;30.35,-38.22,;29.01,-37.45,;31.68,-37.45,;31.67,-35.91,;30.34,-35.14,;28.94,-35.78,;27.9,-34.63,;28.66,-33.3,;29.06,-31.8,;27.57,-31.41,;27.17,-32.9,;30.17,-33.61,;33.01,-38.21,;36.93,-38.98,;37.7,-40.32,;36.93,-41.65,;39.24,-40.32,;40.01,-38.99,;41.55,-38.98,;39.23,-37.65,;37.69,-37.66,;37.39,-36.28,)|
CNC(=O)c1c(oc2ccc(O)c(CN3CCC4(COC4)C3)c12)-c1ccc(O)c(C)c1
CNC(=O)c1c(oc2ccc(O)c(CN3CCC4(COC4)C3)c12)-c1ccc(O)cc1C
Oc1ccc(cc1)-c1oc2ccc(O)c(CNCC3(O)CC3)c2c1C(=O)N1CCC1
Oc1ccc(cc1)-c1oc2ccc(O)c(CNCC3(O)CC3)c2c1C(=O)N1CC(F)C1
CNC(=O)c1c(oc2ccc(O)c(CN3CCCC3)c12)-c1ccc(O)cn1
Oc1ccc(nc1)-c1oc2ccc(O)c(CN3CCCCC3)c2c1C(=O)N1CCC1
Oc1ccc(nc1)-c1oc2ccc(O)c(CN3CCCC3)c2c1C(=O)N1CCC1
Oc1ccc(nc1)-c1oc2ccc(O)c(CN3CCCCC3)c2c1C(=O)N1CC(F)C1
CC(=O)c1c(oc2ccc(O)c(CN3CCC4(COC4)C3)c12)-c1ccc(O)cn1
CC(=O)c1c(oc2ccc(O)c(CN3CCC3)c12)-c1ccc(O)cn1
CC(=O)c1c(oc2ccc(O)c(CN3CCCC3)c12)-c1ccc(O)cn1
CC(=O)c1c(oc2ccc(O)c(CN3CCC3)c12)-c1cc(C)c(O)cn1
Oc1ccc2c3oc4ccc(O)c(CN5CCC(F)CC5)c4c3c(=O)oc2c1
Oc1ccc2c3oc4ccc5OCN(Cc5c4c3c(=O)oc2c1)C1CCCC1
COc1ccc(CCNC(=O)c2nc(no2)-c2ccc(OC)c(OC)c2)cc1OC
COc1ccc(CNC(=O)c2nc(no2)-c2ccc(OC)c(OC)c2)cc1OC
COc1ccc(cc1OC)-c1noc(n1)C(=O)NCCc1ccccc1
COc1ccc(CCNC(=O)c2nc(no2)-c2ccccc2)cc1OC
Oc1ccc(CCNC(=O)c2nc(no2)-c2ccc(O)c(O)c2)cc1O
O=C(NCCc1ccccc1)c1nc(no1)-c1ccccc1
COc1ccc(cc1OC)-c1noc(n1)C(=O)NCCc1cccnc1
COc1ccc(cc1OC)-c1noc(n1)C(=O)NCCN1CCOCC1
COc1ccc(CCNC(=O)c2nc(no2)-c2ccc(OC)c(OC)c2)cc1
COc1cccc(CCNC(=O)c2nc(no2)-c2ccc(OC)c(OC)c2)c1
COc1ccc(cc1OC)-c1noc(n1)C(=O)NCCc1ccc(cc1)C(O)=O
COc1ccc(cc1OC)-c1noc(n1)C(=O)NCCc1ccc(cc1)C(N)=O
CNC(=O)c1ccc(CCNC(=O)c2nc(no2)-c2ccc(OC)c(OC)c2)cc1
COc1ccc(cc1OC)-c1noc(n1)C(=O)NCCc1ccc(cc1)C(=O)N(C)C
COc1ccc(cc1OC)-c1noc(n1)C(=O)NCCc1ccc(cc1)C(=O)N1CCC1
COc1ccc(cc1OC)-c1noc(n1)C(=O)NCCc1ccc(nc1)C(=O)N1CCC1
COC1CN(C1)C(=O)c1ccc(CCNC(=O)c2nc(no2)-c2ccc(OC)c(OC)c2)cc1
COc1ccc(cc1OC)-c1noc(n1)C(=O)NCCc1ccc(cc1)C(=O)N1CC(F)C1
COc1ccc(cc1OC)-c1noc(n1)C(=O)NCCc1ccc(cc1)C(=O)N1CC(F)(F)C1
COc1ccc(cc1OC)-c1noc(n1)C(=O)NCCc1ccc(cc1)C(=O)N1CC2(COC2)C1
COc1ccc(cc1OC)-c1noc(n1)C(=O)NC(CO)Cc1ccccc1
COc1ccc(cc1OC)-c1noc(n1)C(=O)NCC(C)(C)c1ccccc1
COc1ccc(cc1OC)-c1noc(n1)C(=O)NC[C@H](C)c1ccccc1 |r|
COc1ccc(cc1OC)-c1noc(n1)C(=O)NCC(C)c1ccccc1
COc1ccc(cc1OC)-c1noc(n1)C(=O)NC(Cc1ccccc1)C#N
COc1ccc(cc1F)-c1noc(n1)C(=O)NCCc1ccc(cc1)C(=O)N1CCC1
COc1cc(ccc1F)-c1noc(n1)C(=O)NCCc1ccc(cc1)C(=O)N1CCC1
O=C(NCCc1ccc(cc1)C(=O)N1CCC1)c1nc(no1)-c1ccc2nc[nH]c2c1
O=C(NCCc1ccc(cc1)C(=O)N1CCC1)c1nc(no1)-c1ccc2ccoc2c1
O=C(NCCc1ccc(cc1)C(=O)N1CCC1)c1nc(no1)-c1ccc2cc[nH]c2c1
O=C(NCCc1ccc(cc1)C(=O)N1CCC1)c1nc(no1)-c1ccc2cn[nH]c2c1
COc1cccc(c1)-c1noc(n1)C(=O)NCCc1ccc(cc1)C(=O)N1CCC1
COC1CN(C1)C(=O)c1ccc(CCNC(=O)c2nc(no2)-c2ccc(OC)c(OCC3CC3)c2)cc1
COC1CN(C1)C(=O)c1ccc(CCNC(=O)c2nc(no2)-c2ccc(OC)c(OC3CCC3)c2)cc1
COC1CN(C1)C(=O)c1ccc(CCNC(=O)c2nc(no2)-c2ccc(OC)c(OC3CC3)c2)cc1
COC1CN(C1)C(=O)c1ccc(CCNC(=O)c2nc(no2)-c2ccc(OC)c(OCC3(O)CC3)c2)cc1
COc1ccc(CCN(C)C(=O)c2nc(no2)-c2ccc(OC)c(OC)c2)cc1OC
COc1ccc(CCNC(=O)c2cc(on2)-c2ccc(OC)c(OC)c2)cc1OC
COc1ccc(CCC(=O)Nc2cc(on2)-c2ccc(OC)c(OC)c2)cc1OC
COc1ccc(cc1OC)-c1noc(CNCCc2ccccc2)n1
COc1ccc(cc1OC)-c1nc(no1)C(=O)NCCc1ccccc1
COc1ccc(cc1OC)-c1coc(c1)C(=O)NCCc1ccccc1
COc1ccc(cc1OC)-c1cccc(c1)C(=O)NCCc1ccccc1
COc1ccc(cc1OC)-c1n[nH]c(n1)C(=O)NCCc1ccc(cc1)C(=O)N1CCC1
COC1CN(C1)C(=O)c1ccc(CCNC(=O)c2nnc(o2)-c2ccc(OC)c(OC)c2)cc1
COc1ccc(cc1OC)-c1noc(n1)C(=O)NC(Cc1ccc(cc1)C(=O)N1CCC1)C#N
COc1ccc(cc1OC)-c1noc(n1)C(=O)NC(Cc1ccc(cc1)C(=O)N1CC2(COC2)C1)C#N
COC1CN(C1)C(=O)c1ccc(CC(NC(=O)c2nc(no2)-c2ccc(OC)c(OC)c2)C#N)cc1
COC1CN(C1)C(=O)c1ccc(CC(NC(=O)c2nc(no2)-c2ccc(OC)c(OCC3(O)CC3)c2)C#N)cc1
Oc1ccc(cc1)-c1cc(=O)c2c(CN3CCCCC3)c(O)ccc2o1
CCOC(=O)c1c(-c2ccccc2)oc2ccc(O)c(CN3CCCCC3)c12
CNC(=O)c1c(-c2ccccc2)oc2ccc(O)c(CN3CCCCC3)c12
O=c1cc(-c2ccccc2O)oc2ccc(O)c(CN3CCC3)c12