Sulfuric acid,mono[(2S,3aS,6R,7aS)-2-[[[4-[(aminoiminomethyl)amino]butyl]amino]carbonyl]octahydro-1-[(2R,3S)-2-[[(2R)-2-hydroxy-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-3-methyl-1-oxopentyl]-1H-indol-6-yl]ester

Base Information

Chemical Name:Sulfuric acid,mono[(2S,3aS,6R,7aS)-2-[[[4-[(aminoiminomethyl)amino]butyl]amino]carbonyl]octahydro-1-[(2R,3S)-2-[[(2R)-2-hydroxy-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-3-methyl-1-oxopentyl]-1H-indol-6-yl]ester
CAS No.:167228-01-5
Molecular Formula:C29H46 N6 O9 S
Molecular Weight:654.785
Hs Code.:
Mol file:167228-01-5.mol

Sulfuric acid,mono[(2S,3aS,6R,7aS)-2-[[[4-[(aminoiminomethyl)amino]butyl]amino]carbonyl]octahydro-1-[(2R,3S)-2-[[(2R)-2-hydroxy-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-3-methyl-1-oxopentyl]-1H-indol-6-yl]ester

Synonyms:1H-Indole-2-carboxamide,N-[4-[(aminoiminomethyl)amino]butyl]octahydro-1-[(2R,3S)-2-[[(2R)-2-hydroxy-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-3-methyl-1-oxopentyl]-6-(sulfooxy)-,(2S,3aS,6R,7aS)- (9CI); 1H-Indole-2-carboxamide,N-[4-[(aminoiminomethyl)amino]butyl]octahydro-1-[2-[[2-hydroxy-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-3-methyl-1-oxopentyl]-6-(sulfooxy)-,[2S-[1[2S*(S*),3R*],2a,3ab,6b,7ab]]-; (-)-Aeruginosin 98-B; Aeruginosin 98B; Aeruginosine 98B

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Chemical Property of Sulfuric acid,mono[(2S,3aS,6R,7aS)-2-[[[4-[(aminoiminomethyl)amino]butyl]amino]carbonyl]octahydro-1-[(2R,3S)-2-[[(2R)-2-hydroxy-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-3-methyl-1-oxopentyl]-1H-indol-6-yl]ester

Chemical Property:

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Safty Information:

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Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Technology Process of Sulfuric acid,mono[(2S,3aS,6R,7aS)-2-[[[4-[(aminoiminomethyl)amino]butyl]amino]carbonyl]octahydro-1-[(2R,3S)-2-[[(2R)-2-hydroxy-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-3-methyl-1-oxopentyl]-1H-indol-6-yl]ester

There total 27 articles about Sulfuric acid,mono[(2S,3aS,6R,7aS)-2-[[[4-[(aminoiminomethyl)amino]butyl]amino]carbonyl]octahydro-1-[(2R,3S)-2-[[(2R)-2-hydroxy-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-3-methyl-1-oxopentyl]-1H-indol-6-yl]ester which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 98.0%

: 1412914-84-1
(2S,3aS,6R,7aS)-1-((2R,3S)-2-((R)-3-(4-(benzyloxy)phenyl)-2-(hydroxy)propanamido)-3-methylpentanoyl)-2-((4-(2,3-dibenzyloxycarbonyl)guanidinobutyl)carbamoyl)octahydro-1H-indol-6-yl hydrogen sulfate

: 167228-01-5
aeruginosin 98B

Guidance literature:: With hydrogen; palladium(II) hydroxide; In methanol; at 20 ℃; for 6h; Inert atmosphere;
DOI:10.1021/ja309947n

Reference yield:

: 1412914-79-4
N-(4-N-Boc-aminobutyl)-1,2-bis(benzyloxycarbonyl)guanidine

: 167228-01-5
aeruginosin 98B

Guidance literature:: Multi-step reaction with 5 steps

1: trifluoroacetic acid / dichloromethane / 6 h / 0 °C / Inert atmosphere

2: triethylamine; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; benzotriazol-1-ol / dichloromethane; N,N-dimethyl-formamide / 4 h / 0 - 20 °C / Inert atmosphere

3: sulfur trioxide pyridine complex / pyridine / 3 h / 40 °C / Inert atmosphere

4: pyridine hydrogenfluoride / acetonitrile / 20 h / 0 - 20 °C / Inert atmosphere

5: hydrogen; palladium(II) hydroxide / methanol / 6 h / 20 °C / Inert atmosphere

With hydrogen; palladium(II) hydroxide; sulfur trioxide pyridine complex; benzotriazol-1-ol; pyridine hydrogenfluoride; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; triethylamine; trifluoroacetic acid; In pyridine; methanol; dichloromethane; N,N-dimethyl-formamide; acetonitrile;
DOI:10.1021/ja309947n

Reference yield:

: N-(4-aminobutyl)-1,2-bis(benzyloxycarbonyl)guanidine

: 167228-01-5
aeruginosin 98B

Guidance literature:: Multi-step reaction with 4 steps

1: triethylamine; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; benzotriazol-1-ol / dichloromethane; N,N-dimethyl-formamide / 4 h / 0 - 20 °C / Inert atmosphere

2: sulfur trioxide pyridine complex / pyridine / 3 h / 40 °C / Inert atmosphere

3: pyridine hydrogenfluoride / acetonitrile / 20 h / 0 - 20 °C / Inert atmosphere

4: hydrogen; palladium(II) hydroxide / methanol / 6 h / 20 °C / Inert atmosphere

With hydrogen; palladium(II) hydroxide; sulfur trioxide pyridine complex; benzotriazol-1-ol; pyridine hydrogenfluoride; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; triethylamine; In pyridine; methanol; dichloromethane; N,N-dimethyl-formamide; acetonitrile;
DOI:10.1021/ja309947n