 Home > Encyclopedia > ((4R,7S)-7-((2S,3R)-1-(L-seryl)-3-hydroxypyrrolidine-2-carboxamido)-12,14-dihydroxy-11-methyl-6,10-dioxo-1,3,4,5,6,7,8,10-octahydrobenzo[j][1]oxa[8]thia[5]azacyclododecine-4-carbonyl)-L-alanine

((4R,7S)-7-((2S,3R)-1-(L-seryl)-3-hydroxypyrrolidine-2-carboxamido)-12,14-dihydroxy-11-methyl-6,10-dioxo-1,3,4,5,6,7,8,10-octahydrobenzo[j][1]oxa[8]thia[5]azacyclododecine-4-carbonyl)-L-alanine

((4R,7S)-7-((2S,3R)-1-(L-seryl)-3-hydroxypyrrolidine-2-carboxamido)-12,14-dihydroxy-11-methyl-6,10-dioxo-1,3,4,5,6,7,8,10-octahydrobenzo[j][1]oxa[8]thia[5]azacyclododecine-4-carbonyl)-L-alanine structure

CAS No:
147214-63-9
Formula:
C26H35N5O12S
Chemical Name:
((4R,7S)-7-((2S,3R)-1-(L-seryl)-3-hydroxypyrrolidine-2-carboxamido)-12,14-dihydroxy-11-methyl-6,10-dioxo-1,3,4,5,6,7,8,10-octahydrobenzo[j][1]oxa[8]thia[5]azacyclododecine-4-carbonyl)-L-alanine
Synonyms:
cyclothialidine;Ro 09-1437;Cyclothialidine;147214-63-9;Ro 09-1437;((4R,7S)-7-((2S,3R)-1-(L-seryl)-3-hydroxypyrrolidine-2-carboxamido)-12,14-dihydroxy-11-methyl-6,10-dioxo-1,3,4,5,6,7,8,10-octahydrobenzo[j][1]oxa[8]thia[5]azacyclododecine-4-carbonyl)-L-alanine;CHEMBL431453;SCHEMBL9038881;Ro-091437;L-Alanine, N-(S-((2-carboxy-4,6-dihydroxy-3-methylphenyl)methyl)-N-(N-(cis-3-hydroxy-1-L-seryl-L-prolyl)-L-seryl)-L-cysteinyl)-, kappa-lactone

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((4R,7S)-7-((2S,3R)-1-(L-seryl)-3-hydroxypyrrolidine-2-carboxamido)-12,14-dihydroxy-11-methyl-6,10-dioxo-1,3,4,5,6,7,8,10-octahydrobenzo[j][1]oxa[8]thia[5]azacyclododecine-4-carbonyl)-L-alanine Basic Attributes

Molecular Weight：

641.6 g/mol

Exact Mass：

641.20029274 g/mol

Characteristics

PSA：

303 Å²

Drug Information

MeSH：

Compounds that inhibit the activity of DNA TOPOISOMERASE II. Included in this category are a variety of ANTINEOPLASTIC AGENTS which target the eukaryotic form of topoisomerase II and ANTIBACTERIAL AGENTS which target the prokaryotic form of topoisomerase II. (See all compounds classified as Topoisomerase II Inhibitors.)

MeSH Entry Terms：

cyclothialidine

Computed Properties

Molecular Weight:641.6
XLogP3:-4.5
Hydrogen Bond Donor Count:9
Hydrogen Bond Acceptor Count:14
Rotatable Bond Count:7
Exact Mass:641.20029274
Monoisotopic Mass:641.20029274
Topological Polar Surface Area:303
Heavy Atom Count:44
Complexity:1110
Defined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: fluorene; oroxylin a found in which plant; lithium acetate; acrylic polymer; magnesium phosphate formula; ethyl acetate safety data sheet

Guide of ((4R,7S)-7-((2S,3R)-1-(L-seryl)-3-hydroxypyrrolidine-2-carboxamido)-12,14-dihydroxy-11-methyl-6,10-dioxo-1,3,4,5,6,7,8,10-octahydrobenzo[j][1]oxa[8]thia[5]azacyclododecine-4-carbonyl)-L-alanine

Basic Attributes
Characteristics
Drug Information
Computed Properties

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