(3R,6S)-3-hydroxy-3-[(3-hydroxyphenyl)methyl]-1,4-dimethyl-6-[(4-nitro-1H-indol-3-yl)methyl]piperazine-2,5-dione
-
![(3R,6S)-3-hydroxy-3-[(3-hydroxyphenyl)methyl]-1,4-dimethyl-6-[(4-nitro-1H-indol-3-yl)methyl]piperazine-2,5-dione structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/987483525a8a4c82990af39bcae2c148.png "(3R,6S)-3-hydroxy-3-[(3-hydroxyphenyl)methyl]-1,4-dimethyl-6-[(4-nitro-1H-indol-3-yl)methyl]piperazine-2,5-dione")
(3R,6S)-3-hydroxy-3-[(3-hydroxyphenyl)methyl]-1,4-dimethyl-6-[(4-nitro-1H-indol-3-yl)methyl]piperazine-2,5-dione
structure -
-
CAS No:
122380-18-1
-
Formula:
C22H22N4O6
-
Chemical Name:
(3R,6S)-3-hydroxy-3-[(3-hydroxyphenyl)methyl]-1,4-dimethyl-6-[(4-nitro-1H-indol-3-yl)methyl]piperazine-2,5-dione
-
Synonyms:
thaxtomin A;thaxtomine A;Thaxtomin A;Thaxtomine A;122380-18-1;(3R,6S)-3-hydroxy-3-[(3-hydroxyphenyl)methyl]-1,4-dimethyl-6-[(4-nitro-1H-indol-3-yl)methyl]piperazine-2,5-dione;Thaztomin A;Phytotoxin 1 (Streptomyces scabies);NSC630669;Thaxtomin A;2,5-Piperazinedione, 3-hydroxy-3-((3-hydroxyphenyl)methyl)-1,4-dimethyl-6-((4-nitro-1H-indol-3-yl)methyl)-, (3R,6S)-;2,5-Piperazinedione, 3-hydroxy-3-[(3-hydroxyphenyl)methyl]-1,4-dimethyl-6-[(4-nitro-1H-indol-3-yl)methyl]-, (3R,6S)-;CHEMBL2270642;SCHEMBL12381685;ZINC5889725;NSC-630669;J-004796;2,5-Piperazinedione, 3-hydroxy-3-((3-hydroxyphenyl)methyl)-1,4-dimethyl-6-((4-nitro-1H-indol-3-yl)methyl)-, (3R-trans)-
-
CAS No:
(3R,6S)-3-hydroxy-3-[(3-hydroxyphenyl)methyl]-1,4-dimethyl-6-[(4-nitro-1H-indol-3-yl)methyl]piperazine-2,5-dione Basic Attributes
438.4 g/mol
438.15393443 g/mol
630669
Computed Properties
Molecular Weight:438.4
XLogP3:1.9
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:438.15393443
Monoisotopic Mass:438.15393443
Topological Polar Surface Area:143
Heavy Atom Count:32
Complexity:759
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Request for Quotation