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CHEBI:125237 - (4R,5'R)-2-benzoyl-2'-[4-(3-hydroxypropoxy)phenyl]-5'-phenyl-3-spiro[1,5-dihydro-2-benzazepine-4,4'-5H-oxazole]one

ChEBI IDCHEBI:125237
ChEBI Name(4R,5'R)-2-benzoyl-2'-[4-(3-hydroxypropoxy)phenyl]-5'-phenyl-3-spiro[1,5-dihydro-2-benzazepine-4,4'-5H-oxazole]one
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FormulaC34H30N2O5
Net Charge0
Average Mass546.623
Monoisotopic Mass546.21547
SMILESO=C(c1ccccc1)N1Cc2ccccc2C[C@]2(N=C(c3ccc(OCCCO)cc3)O[C@@H]2c2ccccc2)C1=O
InChIInChI=1S/C34H30N2O5/c37-20-9-21-40-29-18-16-25(17-19-29)31-35-34(30(41-31)24-10-3-1-4-11-24)22-27-14-7-8-15-28(27)23-36(33(34)39)32(38)26-12-5-2-6-13-26/h1-8,10-19,30,37H,9,20-23H2/t30-,34-/m1/s1
InChIKeyBLDNBMYAMKDOHW-KAODMTDESA-N
ChEBI Ontology
Outgoing Relation(s)
(4R,5'R)-2-benzoyl-2'-[4-(3-hydroxypropoxy)phenyl]-5'-phenyl-3-spiro[1,5-dihydro-2-benzazepine-4,4'-5H-oxazole]one (CHEBI:125237) is a benzazepine (CHEBI:35676)
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