9-[4-(4-methoxyphenyl)butyl]-3-methyl-6-methylidene-12-propan-2-yl-1-oxa-4,7,10-triazacyclododecane-2,5,8,11-tetrone
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![9-[4-(4-methoxyphenyl)butyl]-3-methyl-6-methylidene-12-propan-2-yl-1-oxa-4,7,10-triazacyclododecane-2,5,8,11-tetrone structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/55db6becff8d41d484098019e39957c8.png "9-[4-(4-methoxyphenyl)butyl]-3-methyl-6-methylidene-12-propan-2-yl-1-oxa-4,7,10-triazacyclododecane-2,5,8,11-tetrone")
9-[4-(4-methoxyphenyl)butyl]-3-methyl-6-methylidene-12-propan-2-yl-1-oxa-4,7,10-triazacyclododecane-2,5,8,11-tetrone
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CAS No:
87105-10-0
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Formula:
C24H33N3O6
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Chemical Name:
9-[4-(4-methoxyphenyl)butyl]-3-methyl-6-methylidene-12-propan-2-yl-1-oxa-4,7,10-triazacyclododecane-2,5,8,11-tetrone
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Synonyms:
(2-amino-6-(4-methoxyphenyl)hexanoic acid)-AM toxin I;(L-2-amino-6-(p-methoxyphenyl)hexanoic acid)-AM toxin I;(L-Amh3)-AM toxin I;AM toxin I, (2-amino-6-(4-methoxyphenyl)hexanoic acid)-;AMPHA-AM toxin I;87105-10-0;Ampha-AM toxin I;(L-Amh3)-AM toxin I;(2-Amino-6-(4-methoxyphenyl)hexanoic acid)-AM toxin I;(L-2-Amino-6-(p-methoxyphenyl)hexanoic acid)-AM toxin I;AM Toxin I, (2-amino-6-(4-methoxyphenyl)hexanoic acid)-;DTXSID501007341;5,8,11-Trihydroxy-9-[4-(4-methoxyphenyl)butyl]-3-methyl-6-methylidene-12-(propan-2-yl)-1-oxa-4,7,10-triazacyclododeca-4,7,10-trien-2-one;L-Alanine, N-(2,3-didehydro-N-(N-(2-hydroxy-3-methyl-1-oxobutyl)-6-(4-methoxyphenyl)-L-norleucyl)alanyl)-, (S)-
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CAS No:
9-[4-(4-methoxyphenyl)butyl]-3-methyl-6-methylidene-12-propan-2-yl-1-oxa-4,7,10-triazacyclododecane-2,5,8,11-tetrone Basic Attributes
459.5 g/mol
459.23693578 g/mol
Computed Properties
Molecular Weight:459.5
XLogP3:3.6
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:459.23693578
Monoisotopic Mass:459.23693578
Topological Polar Surface Area:123
Heavy Atom Count:33
Complexity:730
Undefined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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