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Molecular Structure:
CAS No.:
145590-44-9 ;156053-89-3 ;
170098-38-1
Product Name.:
ALVIMOPAN
CCD No.:CCD00821579
Formula:
C25 H32 N2 O4
MolWeight:
424.538
Mol:
ALVIMOPAN.mol
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Basic Information
Product Name:
ALVIMOPAN
CAS:
145590-44-9
;
156053-89-3
;170098-38-1
English Synonyms:
N-[(2S)-2-[[(3R,4R)-4-(3-HYDROXYPHENYL)-3,4-DIMETHYL-1-PIPERIDINYL]METHYL]-1-OXO-3-PHENYLPROPYL]-GLYCINE
;
2-((S)-2-BENZYL-3-((3R,4R)-4-(3-HYDROXYPHENYL)-3,4-DIMETHYLPIPERIDIN-1-YL)PROPANAMIDO)ACETIC ACID
;
2-([(2S)-2-([(3R,4R)-4-(3-HYDROXYPHENYL)-3,4-DIMETHYLPIPERIDIN-1-YL]METHYL)-3-PHENYLPROPANOYL]AMINO)ACETIC ACID
;
ADL 8-2698
;
GLYCINE, N-[(2S)-2-[[(3R,4R)-4-(3-HYDROXYPHENYL)-3,4-DIMETHYL-1-PIPERIDINYL]METHYL]-1-OXO-3-PHENYLPROPYL]-
;
ENTEREG
;
ALVIMOPAN (DIHYDRATE)
;
N-[(2S)-2-BENZYL-3-[(3R,4R)-4-(3-HYDROXYPHENYL)-3,4-DIMETHYL-1-PIPERIDINYL]PROPANOYL)GLYCINE
;
TRANS-3,4-DIMETHYL-4-(3-HYDROXYPHENYL) PIPERIDINE
;
ALVIMOPAN
MDL Number.:
MFCD09838268
H bond acceptor:
6
H bond donor:
3
Smile:
C[C@H]1CN(CC[C@@]1(C)c2cccc(c2)O)C[C@H](Cc3ccccc3)C(=O)NCC(=O)O
InChi:
InChI=1S/C25H32N2O4/c1-18-16-27(12-11-25(18,2)21-9-6-10-22(28)14-21)17-20(24(31)26-15-23(29)30)13-19-7-4-3-5-8-19/h3-10,14,18,20,28H,11-13,15-17H2,1-2H3,(H,26,31)(H,29,30)/t18-,20-,25+/m0/s1
InChiKey:
InChIKey=UPNUIXSCZBYVBB-JVFUWBCBSA-N
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