2-[[2-[3-[3-[(1-adamantylcarbamoylamino)methyl]phenyl]phenyl]-6-[4-(hydroxymethyl)phenyl]-1,3-dioxan-4-yl]methylsulfanyl]benzoic acid
Molecular Formula:
C43H46N2O6S
InChI: InChI=1/C43H46N2O6S/c46-25-27-11-13-32(14-12-27)38-20-36(26-52-39-10-2-1-9-37(39)40(47)48)50-41(51-38)35-8-4-7-34(19-35)33-6-3-5-28(18-33)24-44-42(49)45-43-21-29-15-30(22-43)17-31(16-29)23-43/h1-14,18-19,29-31,36,38,41,46H,15-17,20-26H2,(H,47,48)(H2,44,45,49)/f/h44-45,47H
InChIKey: InChIKey=DJOSSMADINKBKA-NLRCAPKUCG
SMILES: C1C2CC3CC1CC(C2)(C3)NC(=O)NCC4=CC=CC(=C4)C5=CC(=CC=C5)C6OC(CC(O6)C7=CC=C(C=C7)CO)CSC8=CC=CC=C8C(=O)O
Names:
2-[[2-[3-[3-[(1-adamantylcarbamoylamino)methyl]phenyl]phenyl]-6-[4-(hydroxymethyl)phenyl]-1,3-dioxan-4-yl]methylsulfanyl]benzoic acid
Registries:
PubChem CID 4452082
PubChem ID 6563456
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