Batrachotoxinin A, 20-(4,5-dimethylpyrrole-3-carboxylate)
Molecular Formula:
C31H42N2O6
InChI: InChI=1/C31H42N2O6/c1-18-19(2)32-16-22(18)26(35)38-20(3)23-8-9-30-24-7-6-21-14-29(36)11-10-27(21,4)31(24,39-29)25(34)15-28(23,30)17-33(5)12-13-37-30/h7-8,16,20-21,25,32,34,36H,6,9-15,17H2,1-5H3/t20u,21-,25-,27+,28?,29+,30u,31?/m1/s1
InChIKey: InChIKey=KSUKORCMHPRGFT-DHAYZFELBZ
SMILES: CC1=C(NC=C1C(=O)OC(C)C2=CCC34C2(CC(C56C3=CCC7C5(CCC(C7)(O6)O)C)O)CN(CCO4)C)C
Names:
BATRACHOTOXININ A, 20-alpha-(4,5-DIMETHYL-1H-PYRROLE-3-CARBOXYLATE)
Batrachotoxinin A, 20-(4,5-dimethylpyrrole-3-carboxylate)
32476-55-4
4,5-Dimethylbatrachotoxin
Registries:
PubChem CID 36144
PubChem ID 177691
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