DIOX2_016813
Molecular Formula:
C39H43N5O5
InChI: InChI=1/C39H43N5O5/c45-26-29-14-16-30(17-15-29)35-23-34(25-43-20-18-39(19-21-43)37(46)41-27-44(39)33-12-5-2-6-13-33)48-36(49-35)31-10-7-11-32(22-31)42-38(47)40-24-28-8-3-1-4-9-28/h1-17,22,34-36,45H,18-21,23-27H2,(H,41,46)(H2,40,42,47)/t34-,35+,36+/m0/s1/f/h40-42H
InChIKey: InChIKey=MLMMYYFNWIXJKQ-VODJAMHHDI
SMILES: C1CN(CCC12C(=O)NCN2C3=CC=CC=C3)CC4CC(OC(O4)C5=CC(=CC=C5)NC(=O)NCC6=CC=CC=C6)C7=CC=C(C=C7)CO
Names:
DIOX2_016813
3-benzyl-1-[3-[(2R,4R,6S)-4-[4-(hydroxymethyl)phenyl]-6-[(4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]decan-8-yl)methyl]-1,3-dioxan-2-yl]phenyl]urea
Registries:
PubChem CID 6698091
PubChem ID 11323812
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