(6S,12R,18S)-12-benzyl-16-thia-1,4,10,13-tetrazatricyclo[16.3.0.06,10]henicosane-2,5,11,14-tetrone
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![(6S,12R,18S)-12-benzyl-16-thia-1,4,10,13-tetrazatricyclo[16.3.0.06,10]henicosane-2,5,11,14-tetrone structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/25dba511d95041cb802b7a18522258a4.png "(6S,12R,18S)-12-benzyl-16-thia-1,4,10,13-tetrazatricyclo[16.3.0.06,10]henicosane-2,5,11,14-tetrone")
(6S,12R,18S)-12-benzyl-16-thia-1,4,10,13-tetrazatricyclo[16.3.0.06,10]henicosane-2,5,11,14-tetrone
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CAS No:
99781-72-3
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Formula:
C23H30N4O4S
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Chemical Name:
(6S,12R,18S)-12-benzyl-16-thia-1,4,10,13-tetrazatricyclo[16.3.0.06,10]henicosane-2,5,11,14-tetrone
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Synonyms:
cyclo(Gly-Pro-psi(CH2S)-Gly-Phe-Pro);cyclo(glycyl-prolyl-psi(CH2S)-glycyl-phenylalanyl-prolyl);cyclo(GP-p(CH2S)-GFP);99781-72-3;Cyclo(GP-p(CH2S)-gfp);Cyclo(gly-pro-psi(CH2S)-gly-phe-pro);Cyclo(glycyl-prolyl-psi(CH2S)-glycyl-phenylalanyl-prolyl);DTXSID60912473;6-Benzyl-8,19-dihydroxy-2,3,6,9,11a,12,13,14,17,19a-decahydro-5H,11H-dipyrrolo[2,1-c:2',1'-i][1,4,7,10,13]thiatetraazacyclopentadecine-5,16(1H)-dione
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CAS No:
(6S,12R,18S)-12-benzyl-16-thia-1,4,10,13-tetrazatricyclo[16.3.0.06,10]henicosane-2,5,11,14-tetrone Basic Attributes
458.6 g/mol
458.19877662 g/mol
Computed Properties
Molecular Weight:458.6
XLogP3:1.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:458.19877662
Monoisotopic Mass:458.19877662
Topological Polar Surface Area:124
Heavy Atom Count:32
Complexity:727
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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