 Home > Encyclopedia > (2S)-N-[(2R,5S)-1-(2-aminophenyl)-5-[[(2R)-2-aminopropanoyl]amino]-2-formyl-6-methyl-1,4-dioxo-3-phenylhept-6-en-2-yl]-N-methylpyrrolidine-2-carboxamide

(2S)-N-[(2R,5S)-1-(2-aminophenyl)-5-[[(2R)-2-aminopropanoyl]amino]-2-formyl-6-methyl-1,4-dioxo-3-phenylhept-6-en-2-yl]-N-methylpyrrolidine-2-carboxamide

(2S)-N-[(2R,5S)-1-(2-aminophenyl)-5-[[(2R)-2-aminopropanoyl]amino]-2-formyl-6-methyl-1,4-dioxo-3-phenylhept-6-en-2-yl]-N-methylpyrrolidine-2-carboxamide structure

CAS No:
110297-46-6
Formula:
C30H37N5O5
Chemical Name:
(2S)-N-[(2R,5S)-1-(2-aminophenyl)-5-[[(2R)-2-aminopropanoyl]amino]-2-formyl-6-methyl-1,4-dioxo-3-phenylhept-6-en-2-yl]-N-methylpyrrolidine-2-carboxamide
Synonyms:
avellanin B;cyclo(N-Me-Phe-Ala-Val-2-aminobenzoyl-Pro);Avellanin B;110297-46-6;Cyclo(alanylvalyl-2-aminobenzoylprolyl-N-methylphenylalanyl);DTXSID50911571;(2S)-N-[(2R,5S)-1-(2-aminophenyl)-5-[[(2R)-2-aminopropanoyl]amino]-2-formyl-6-methyl-1,4-dioxo-3-phenylhept-6-en-2-yl]-N-methylpyrrolidine-2-carboxamide;Cyclo(N-Me-phe-ala-val-2-aminobenzoyl-pro);N-{5-[(2-Amino-1-hydroxypropylidene)amino]-1-(2-aminophenyl)-2-formyl-6-methyl-1,4-dioxo-3-phenylhept-6-en-2-yl}-N-methylprolinamide

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(2S)-N-[(2R,5S)-1-(2-aminophenyl)-5-[[(2R)-2-aminopropanoyl]amino]-2-formyl-6-methyl-1,4-dioxo-3-phenylhept-6-en-2-yl]-N-methylpyrrolidine-2-carboxamide Basic Attributes

Molecular Weight：

547.6 g/mol

Exact Mass：

547.27946930 g/mol

Characteristics

PSA：

165 Å²

Drug Information

MeSH Entry Terms：

avellanin B

Computed Properties

Molecular Weight:547.6
XLogP3:2.3
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:12
Exact Mass:547.27946930
Monoisotopic Mass:547.27946930
Topological Polar Surface Area:165
Heavy Atom Count:40
Complexity:980
Defined Atom Stereocenter Count:4
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (2S)-N-[(2R,5S)-1-(2-aminophenyl)-5-[[(2R)-2-aminopropanoyl]amino]-2-formyl-6-methyl-1,4-dioxo-3-phenylhept-6-en-2-yl]-N-methylpyrrolidine-2-carboxamide

Basic Attributes
Characteristics
Drug Information
Computed Properties

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