MATERIAL SUPLEMENTARIO DE Y. MACHADO et col.
485
Smiles
Nombre
c1(c(oc2c(c1=O)c(cc(c2)OC)O)c1cc(c(cc1)O)O)O
RHAMNETIN
c12c(oc(cc2=O)c2cc(c(cc2)OC)OC)c(c(c(c1O)OC)OC)OC
DEMETHYLNOBILETIN
c12c(oc(cc2=O)c2ccc(cc2)OC)c(c(c(c1O)OC)OC)OC
GARDENIN B
c1(cc(c2c(c1OC)oc(cc2=O)c1c(cc(cc1)OC)OC)O)OC
5-HYDROXY-2',4',7,8-
TETRAMETHOXYFLAVONE
c1(C(=O)c2ccccc2)c(cc(cc1)OC)O
OXYBENZONE
c1(c(cc(c(c1)C(C)(C)C)O)C(C)(C)C)OC
2,5-DI-t-BUTYL-4-
HYDROXYANISOLE
[N+](CCO)(C)(C)C
CHOLINE CHLORIDE
S(=O)(=O)(Nc1ccc([N+](=O)[O-])cc1)c1ccc(NC(=O)C)cc1
SULFANITRAN
N1C(=O)NC(C1=O)NC(=O)N
ALLANTOIN
N(CCCl)(CCCl)C
MECHLORETHAMINE
c12c(c3c(cc1CCN(C2)C)OCO3)OC
HYDROCOTARNINE
HYDROBROMIDE
[C@@]123[C@@H]([C@@](C(=O)O1)([C@H](C=C3)O)C)[C@@H]([C@]13[C@H]2CC[C@](C1)(C(=
C)C3)O)C(=O)O
GIBBERELLIC ACID
[N+]1(CCCCC[N+]2(C)CCCC2)(C)CCCC1
PENTOLINIUM TARTRATE
[C@]12([C@@](C(=O)CO)(CCC1C1C([C@@]3(C(=CC(=O)CC3)CC1)C)[C@H](C2)O)O)C
HYDROCORTISONE
[C@]12([C@@](C(=O)CO)(CCC1C1C([C@@]3(C(=CC(=O)C=C3)CC1)C)[C@H](C2)O)O)C
PREDNISOLONE
[C@]12([C@@](C(=O)CO)(CCC1C1C([C@@]3(C(=CC(=O)C=C3)CC1)C)C(=O)C2)O)C
PREDNISONE
[C@]12([C@@](C(=O)CO)(CCC1C1C([C@@]3(C(=CC(=O)CC3)CC1)C)C(=O)C2)O)C
CORTISONE
[C@]12([C@@](C(=O)COC(=O)C)(CCC1C1C([C@@]3(C(=CC(=O)CC3)CC1)C)[C@H](C2)O)O)C
HYDROCORTISONE ACETATE
[C@@]12(C(=CC(=O)C=C2)[C@H](CC2C1[C@H](C[C@@]1([C@@](C(=O)CO)(CCC21)O)C)O)C)C METHYLPREDNISOLONE
[C@]12([C@@](C(=O)COC(=O)C)(CCC1C1C(C3(C(=CC(=O)C=C3)CC1)C)[C@H](C2)O)O)C
PREDNISOLONE ACETATE
[C@@]12(C(=CC(=O)CC2)C=CC2C1CC[C@]1(C2CC[C@]1(CCC(=O)[O-])O)C)C
CANRENOIC ACID,
POTASSIUM SALT
C12=CC(=O)C3[C@]([C@@]1(CC[C@@]1([C@@H]2C[C@@](C(=O)O)(CC1)C)C)C)(CCC1[C@@]3(
CC[C@@H](C1(C)C)O)C)C
18alpha-GLYCYRRHETINIC
ACID
