SMILES for Squalene--hopene cyclase

36 SMILES Strings for Squalene--hopene cyclase

Compound Name

SMILES String

CN(CC=C)C\C=C\COc1ccc2c(noc2c1)-c1ccc(Br)cc1

CN(CC=C)C\C=C\COc1ccc(cc1)-c1nsc2cc(Br)ccc12

CN(CCCCCCOc1ccc(C(=O)c2ccc(Br)cc2)c(F)c1)C1CC1

CN(CCCCCCOc1ccc(cc1)C(=O)c1ccc(Br)cc1)CC=C

CN(CCCCCCOc1ccc2c(n[nH]c2c1)-c1ccc(Br)cc1)CC=C

CN(CCCCCCOc1ccc2C(=NOCc2c1)c1ccc(Br)cc1)CC=C |c:13|

CN(CCCCCCOC1CCN(CC1)C(=O)c1ccc(F)cc1)C1CC1

CN(CC=C)C\C=C\COc1ccc2c(coc2c1)-c1ccc(Br)cc1

C[N@@](CCCCCCOc1ccc2c(c1)ccnc2c3ccc(cc3)Br)CC=C

CN(CC=C)C\C=C\COc1ccc2c(csc2c1)-c1ccc(Br)cc1

Cn1c2cc(ccc2c(n1)c3ccc(cc3)Br)OCCCCCC[N@](C)CC=C

C[N@@](CCCCCCOc1ccc2c(c1)occ2c3ccc(cc3)Br)CC=C

C[N@@](CCCCCCOc1ccc2c(c1)snc2c3ccc(cc3)Br)CC=C

CN(CC=C)C\C=C\COc1ccc(cc1)C(=O)c1ccc(Br)cc1

C[N@@](CCCCCCOc1ccc(c(c1)F)C(=O)c2ccc(cc2)Br)CC=C

CN(C1CCC(CC1)c2ccc(cc2)CN3CCCCC3)C(=O)Oc4ccc(cc4)Cl

C[N@@](CCCCCCOc1ccc(cc1)c2c3ccc(cc3sn2)Br)CC=C

C[N@@](C\C=C\COc1ccc(cc1)C(=O)c2ccc(cc2)Br)C3CC3

CN([C@H]1CC[C@@H](CC1)c1ccc(C[N+]2([O-])CCCCC2)cc1)C(=O)Oc1ccc(Cl)cc1 |wU:2.1,wD:5.8,(5.79,.97,;5.79,-.57,;4.45,-1.34,;4.45,-2.88,;3.12,-3.65,;1.78,-2.88,;1.78,-1.34,;3.12,-.57,;.44,-3.65,;-.88,-2.86,;-2.22,-3.63,;-2.24,-5.17,;-3.57,-5.94,;-4.9,-5.16,;-4.91,-6.71,;-4.9,-3.63,;-6.22,-2.86,;-7.56,-3.61,;-7.56,-5.16,;-6.23,-5.94,;-.88,-5.94,;.45,-5.17,;7.13,-1.34,;7.13,-2.88,;8.47,-.57,;9.8,-1.34,;11.13,-.57,;12.46,-1.34,;12.46,-2.88,;13.81,-3.65,;11.13,-3.65,;9.8,-2.88,)|

CN(CCCCCCOc1ccc2c(noc2c1)-c1ccc(Br)cc1)CC=C

C[N@@](CC=C)Cc1ccc(cc1)c2ccc(cc2)C(=O)c3ccc(cc3)Br

CN(C[C@H]1C[C@@H]1COc1ccc(C(=O)c2ccc(Br)cc2)c(F)c1)C1CC1

Clc1ccc(cc1)-[#6](=O)-[#7]-1-[#6]-[#6]\[#6](-[#6]-[#6]-1)=[#6]\c1ccc(cc1)-[#6]-1=[#7]-[#6]-[#6]-[#8]-1 |t:25|

CN(C[C@H]1C[C@@H]1COc1ccc(cc1)C(=O)c1ccc(Br)cc1)C1CC1

CN(CCCCCCOC1CCN(CC1)C(=O)c1ccc(F)cc1)CC=C

CN(CC=C)C\C=C\COc1cc2n(C)nc(-c3ccc(Br)cc3)c2cc1F

C=CC[N@@](C[C@H]1C[C@@H]1COc2ccc(cc2)C(=O)c3ccc(cc3)Br)C4CC4

CN(CCCCCCOc1ccc2c(C)nn(C)c2c1)CC=C

C\C(CC\C=C(/C)CCC(O)C(C)(C)O)=C/COc1ccc2ccc(=O)oc2c1

C\C(CC\C=C(/C)CCC1OC1(C)C)=C/COc1cc2oc(=O)ccc2cc1O

C\C(CC[C@H]1[C@@]2(C)CC[C@@H](O2)C1(C)C)=C/COc1ccc2ccc(=O)oc2c1

CC(=O)Oc1ccc2c(OC(C)=O)c(C\C=C(/C)CC\C=C(/C)CCC3OC3(C)C)c(=O)oc2c1

C\C(CCC1OC1(C)CCC1OC1(C)C)=C/COc1ccc2ccc(=O)oc2c1

[#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#8]-c1ccc2ccc(=O)oc2c1

[#6]\[#6](-[#6])=[#6]/[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])c2ccccc2oc1=O

C\C(CC\C=C(/C)CCC1OC1(C)C)=C/COc1ccc2ccc(=O)oc2c1