Mergocriptine
Molecular Formula:
C33H43N5O5
InChI: InChI=1/C33H43N5O5/c1-17(2)13-26-30(40)37-12-8-11-27(37)33(42)38(26)31(41)32(43-33,18(3)4)35-29(39)20-14-23-21-9-7-10-24-28(21)22(19(5)34-24)15-25(23)36(6)16-20/h7,9-10,14,17-18,20,25-27,34,42H,8,11-13,15-16H2,1-6H3,(H,35,39)/t20-,25-,26+,27+,32-,33+/m1/s1/f/h35H
InChIKey: InChIKey=AFFLEALSHYGOOD-GXEHQXHEDQ
SMILES: CC1=C2CC3C(=CC(CN3C)C(=O)NC4(C(=O)N5C(C(=O)N6CCCC6C5(O4)O)CC(C)C)C(C)C)C7=C2C(=CC=C7)N1
Names:
Mergocriptina [Spanish]
Mergocriptine [INN]
Mergocriptine
Mergocriptinum [Latin]
12'-HYDROXY-2-METHYL-2'-(1-METHYLETHYL)-5'A-(2-METHYLPROPYL)-ERGOTAMAN-3',6',18-
2-Methyl-alpha-ergocryptine
81968-16-3
Registries:
PubChem CID 54803
PubChem ID 192313
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