Compound Q&A

What is (3S,6S,9S,12S,15S,18S,21S,24S)-24-Acetamido-15-(3-amino-3-oxopropyl)-3-carbamoyl-21-(2-carboxyethyl)-9,12-bis(3-guanidinopropyl)-6-methyl-18-(2-(methylthio)ethyl)-5,8,11,14,17,20,23-heptaoxo-4,7,10,13,16,19,22-heptaazaheptacosane-1,27-dioic acid (CAS: 868844-74-0)?

Answer

(3S,6S,9S,12S,15S,18S,21S,24S)-24-Acetamido-15-(3-amino-3-oxopropyl)-3-carbamoyl-21-(2-carboxyethyl)-9,12-bis(3-guanidinopropyl)-6-methyl-18-(2-(methylthio)ethyl)-5,8,11,14,17,20,23-heptaoxo-4,7,10,13,16,19,22-heptaazaheptacosane-1,27-dioic acid
This compound is a complex polyamine derivative with multiple functional groups, including amide, carboxylic acid, and guanidino moieties. Its chemical formula is C30H57N15O12S. It exhibits high molecular complexity and is characterized by its ability to form hydrogen bonds and interact with biological targets, making it a potential candidate for pharmaceutical applications. The compound is known for its structural diversity and functional versatility.

About

English Name (3S,6S,9S,12S,15S,18S,21S,24S)-24-Acetamido-15-(3-amino-3-oxopropyl)-3-carbamoyl-21-(2-carboxyethyl)-9,12-bis(3-guanidinopropyl)-6-methyl-18-(2-(methylthio)ethyl)-5,8,11,14,17,20,23-heptaoxo-4,7,10,13,16,19,22-heptaazaheptacosane-1,27-dioic acid
Molecular Formula C41H70N16O16S
Molecular Weight 1075.1739999999998 g/mol
SMILES O=C(O)C[C@@H](C(N)=O)NC([C@H](C)NC([C@H](CCCNC(N)=N)NC([C@H](CCCNC(N)=N)NC([C@H](CCC(N)=O)NC([C@H](CCSC)NC([C@H](CCC(O)=O)NC([C@@H](NC(C)=O)CCC(O)=O)=O)=O)=O)=O)=O)=O)=O
InChIKey KMACPCJUCHVVGP-FNRPHRCSSA-N
Last Updated: 2025-08-28 11:52

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