2-[(1-{4-[(4R)-4-[(1S,2S,5R,7S,9R,10R,11S,14R,15R,16S)-5-amino-9,16-dihydroxy-2,15-dimethyltetracyclo[8.7.0.02,7.011,15]heptadecan-14-yl]pentanamido]phenyl}-3-[4,7-bis(carboxymethyl)-1,4,7-triazonan-1-yl]propan-2-yl)amino]acetic acid

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Chemical Name:2-[(1-{4-[(4R)-4-[(1S,2S,5R,7S,9R,10R,11S,14R,15R,16S)-5-amino-9,16-dihydroxy-2,15-dimethyltetracyclo[8.7.0.02,7.011,15]heptadecan-14-yl]pentanamido]phenyl}-3-[4,7-bis(carboxymethyl)-1,4,7-triazonan-1-yl]propan-2-yl)amino]acetic acid
CAS No.:1173056-35-3
Molecular Formula:C₄₅H₇₂N₆O₉
Molecular Weight:841.101
Hs Code.:

2-[(1-{4-[(4R)-4-[(1S,2S,5R,7S,9R,10R,11S,14R,15R,16S)-5-amino-9,16-dihydroxy-2,15-dimethyltetracyclo[8.7.0.02,7.011,15]heptadecan-14-yl]pentanamido]phenyl}-3-[4,7-bis(carboxymethyl)-1,4,7-triazonan-1-yl]propan-2-yl)amino]acetic acid

Synonyms:2-[(1-{4-[(4R)-4-[(1S,2S,5R,7S,9R,10R,11S,14R,15R,16S)-5-amino-9,16-dihydroxy-2,15-dimethyltetracyclo[8.7.0.02,7.011,15]heptadecan-14-yl]pentanamido]phenyl}-3-[4,7-bis(carboxymethyl)-1,4,7-triazonan-1-yl]propan-2-yl)amino]acetic acid

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Chemical Property of 2-[(1-{4-[(4R)-4-[(1S,2S,5R,7S,9R,10R,11S,14R,15R,16S)-5-amino-9,16-dihydroxy-2,15-dimethyltetracyclo[8.7.0.02,7.011,15]heptadecan-14-yl]pentanamido]phenyl}-3-[4,7-bis(carboxymethyl)-1,4,7-triazonan-1-yl]propan-2-yl)amino]acetic acid

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Technology Process of 2-[(1-{4-[(4R)-4-[(1S,2S,5R,7S,9R,10R,11S,14R,15R,16S)-5-amino-9,16-dihydroxy-2,15-dimethyltetracyclo[8.7.0.02,7.011,15]heptadecan-14-yl]pentanamido]phenyl}-3-[4,7-bis(carboxymethyl)-1,4,7-triazonan-1-yl]propan-2-yl)amino]acetic acid

There total 9 articles about 2-[(1-{4-[(4R)-4-[(1S,2S,5R,7S,9R,10R,11S,14R,15R,16S)-5-amino-9,16-dihydroxy-2,15-dimethyltetracyclo[8.7.0.02,7.011,15]heptadecan-14-yl]pentanamido]phenyl}-3-[4,7-bis(carboxymethyl)-1,4,7-triazonan-1-yl]propan-2-yl)amino]acetic acid 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: 96.0%

: 1173056-33-1
1-[(2S,5R,9R,15R,16S)-14-{4-[(4-{3-[4,7-bis(carboxymethyl)-1,4,7-triazonan-1-yl]-2-[bis(carboxymethyl)amino]propyl}phenyl)carbamoyl]butan-2-yl}-9,16-dihydroxy-2,15-dimethyltetracyclo[8.7.0.0(2,7).0(11,15)]heptadecan-5-yl]triaz-2-yn-2-ium-1-ide

: 1173056-35-3
2-[(1-{4-[(4R)-4-[(1S,2S,5R,7S,9R,10R,11S,14R,15R,16S)-5-amino-9,16-dihydroxy-2,15-dimethyltetracyclo[8.7.0.02,7.011,15]heptadecan-14-yl]pentanamido]phenyl}-3-[4,7-bis(carboxymethyl)-1,4,7-triazonan-1-yl]propan-2-yl)amino]acetic acid

Guidance literature:: With palladium 10% on activated carbon; hydrogen; In methanol; for 23h;
DOI:10.1039/b823000e

Reference yield:

: 1173056-32-0
1-[(2S,5S,9R,15R,16S)-14-(4-{[4-(3-{4,7-bis[2-(tert-butoxy)-2-oxoethyl]-1,4,7-triazonan-1-yl}-2-{bis[2-(tert-butoxy)-2-oxoethyl]amino}propyl)phenyl]carbamoyl}-butan-2-yl)-9,16-dihydroxy-2,15-dimethyltetracyclo[8.7.0.0(2,7).0(11,15)]heptadecan-5-yl]triaz-2-yn-2-ium-1-ide

: 1173056-35-3
2-[(1-{4-[(4R)-4-[(1S,2S,5R,7S,9R,10R,11S,14R,15R,16S)-5-amino-9,16-dihydroxy-2,15-dimethyltetracyclo[8.7.0.02,7.011,15]heptadecan-14-yl]pentanamido]phenyl}-3-[4,7-bis(carboxymethyl)-1,4,7-triazonan-1-yl]propan-2-yl)amino]acetic acid

Guidance literature:: Multi-step reaction with 2 steps

1: hydrogenchloride / 1,4-dioxane / 24 h / 0 - 20 °C

2: palladium 10% on activated carbon; hydrogen / methanol / 14 h

With hydrogenchloride; palladium 10% on activated carbon; hydrogen; In 1,4-dioxane; methanol;

Reference yield:

: tert-butyl {4-tert-butoxycarbonylmethyl-7-[2-(tert-butoxycarbonylmethyl-amino)-3-(4-nitro-phenyl)-propyl]-[1,4,7]-triazonan-1-yl}-acetate

: 1173056-35-3
2-[(1-{4-[(4R)-4-[(1S,2S,5R,7S,9R,10R,11S,14R,15R,16S)-5-amino-9,16-dihydroxy-2,15-dimethyltetracyclo[8.7.0.02,7.011,15]heptadecan-14-yl]pentanamido]phenyl}-3-[4,7-bis(carboxymethyl)-1,4,7-triazonan-1-yl]propan-2-yl)amino]acetic acid

Guidance literature:: Multi-step reaction with 4 steps

1: palladium 10% on activated carbon; hydrogen / methanol / 14 h / 20 °C / 1034.32 Torr

2: triethylamine / dichloromethane / 48 h / Reflux

3: hydrogenchloride / 1,4-dioxane / 24 h / 0 - 20 °C

4: palladium 10% on activated carbon; hydrogen / methanol / 14 h

With hydrogenchloride; palladium 10% on activated carbon; hydrogen; triethylamine; In 1,4-dioxane; methanol; dichloromethane;