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1-{[(4R,7S,10S,13S,16S)-7-(2-Amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-13-benzyl-16-(4-hydroxybenzyl)-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaazacycloicosan-4-yl]carbonyl}-L-prolyl-N~5~-(d iaminomethylene)-D-ornithylglycinamide acetate (1:1)(CAS: 62288-83-9)

1-{[(4R,7S,10S,13S,16S)-7-(2-Amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-13-benzyl-16-(4-hydroxybenzyl)-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaazacycloicosan-4-yl]carbonyl}-L-prolyl-N~5~-(d
iaminomethylene)-D-ornithylglycinamide acetate (1:1)
CAS Number

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Basic Information

Molecular Formula
C48H68N14O14S2
Molecular Weight
1129.29 g/mol

Physical Properties

Melting Point
170-172°C

Chemical Identifiers

SMILES
CC(=O)O.c1ccc(cc1)C[C@H]2C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CSSCCC(=O)N[C@H](C(=O)N2)Cc3ccc(cc3)O)C(=O)N4CCC[C@H]4C(=O)N[C@H](CCCN=C(N)N)C(=O)NCC(=O)N)CC(=O)N)CCC(=O)N
InChIKey
MLSVJHOYXJGGTR-IFHOVBQLSA-N

Database References

MDL Number
MFCD00133962

FAQ

This compound is a complex organic molecule with a unique structure, including amino acids and heterocycles. It is primarily used in pharmaceutical research for its potential therapeutic applications, particularly in the development of new drugs. Its chemical formula reflects its complex nature, featuring nitrogen, oxygen, and sulfur atoms in a specific arrangement. The compound is stable under normal conditions but requires careful handling due to its chemical complexity.
The main uses of this compound are in pharmaceutical research, where it is explored for its potential to develop new drugs. It has shown promise in research for its biological activity and may be involved in the treatment of various diseases. The compound can be used as a precursor or intermediate in the synthesis of other active pharmaceutical ingredients.
This compound is generally considered safe under controlled laboratory conditions, but proper safety measures are necessary. It should be handled with gloves and in a well-ventilated area. Exposure to direct sunlight or high temperatures should be avoided to prevent degradation. Laboratory personnel should wear appropriate personal protective equipment to minimize the risk of exposure.
This compound should be stored in a cool, dry place away from direct sunlight and heat sources. It is recommended to store it in a tightly sealed container to prevent degradation. The storage temperature should be maintained between 15°C and 25°C. Humidity levels should be controlled to avoid moisture exposure, which could lead to the compound's instability or degradation.

Safety Notice

Please verify product specifications and safety data before use. Contact the supplier for detailed safety information.

Always follow proper handling procedures

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