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3-O-Cyclopropylmethylnaltrexone, TRC

Product Code. 30357497
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250 mg
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Product Code. 30357497 Supplier Toronto Research Chemicals Supplier No. TRCC989360250MG
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Specifications

Chemical Name or Material 3-O-Cyclopropylmethylnaltrexone
CAS 767615-69-0
Molecular Formula C24H29NO4
Quantity 250 mg
Synonym (5alpha)-3-(Cyclopropylmethoxy)-17-(cyclopropylmethyl)-4,5-epoxy-14-hydroxy-morphinan-6-one
InChI Formula InChI=1S/C24H29NO4/c26-17-7-8-24(27)19-11-16-5-6-18(28-13-15-3-4-15)21-20(16)23(24,22(17)29-21)9-10-25(19)12-14-1-2-14/h5-6,14-15,19,22,27H,1-4,7-13H2/t19-,22+,23+,24-/m1/s1
SMILES O[C@]12CCC(=O)[C@@H]3Oc4c(OCC5CC5)ccc6C[C@H]1N(CC7CC7)CC[C@@]23c46
IUPAC Name (4R,4aS,7aR,12bS)-9-(cyclopropylmethoxy)-3-(cyclopropylmethyl)-4a-hydroxy-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7-one
Molecular Weight (g/mol) 395.49
Formula Weight 395.2097
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