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2,2'-((4R,10S,13S,16S,19S,22S,28S,31S,34S,37R)-37-amino-34-((S)-sec-butyl)-4-carboxy-22-(2-carboxyethyl)-16,31-bis((R)-1-hydroxyethyl)-10-(hydroxymethyl)-19,38,38-trimethyl-6,9,12,15,18,21,24,27,30,33,36-undecaoxo-1,2-dithia-5,8,11,14,17,20,23,26,29,32,35-undecaazacyclooctatriacontane-13,28-diyl)diacetic acid compound with acetic acid (1:1)
- Catalog No. :
- ACBGUF661
- CAS No. :
- -
- Molecular Formula :
- C45H72N12O22S2.C2H4O2
- Molecular Weight :
- 1256.45
IUPAC Name:2,2'-((4R,10S,13S,16S,19S,22S,28S,31S,34S,37R)-37-amino-34-((S)-sec-butyl)-4-carboxy-22-(2-carboxyethyl)-16,31-bis((R)-1-hydroxyethyl)-10-(hydroxymethyl)-19,38,38-trimethyl-6,9,12,15,18,21,24,27,30,33,36-undecaoxo-1,2-dithia-5,8,11,14,17,20,23,26,29,32,35-undecaazacyclooctatriacontane-13,28-diyl)diacetic acid--acetic acid (1/1)
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Product Information
| Product Name | 2,2'-((4R,10S,13S,16S,19S,22S,28S,31S,34S,37R)-37-amino-34-((S)-sec-butyl)-4-carboxy-22-(2-carboxyethyl)-16,31-bis((R)-1-hydroxyethyl)-10-(hydroxymethyl)-19,38,38-trimethyl-6,9,12,15,18,21,24,27,30,33,36-undecaoxo-1,2-dithia-5,8,11,14,17,20,23,26,29,32,35-undecaazacyclooctatriacontane-13,28-diyl)diacetic acid compound with acetic acid (1:1) |
|---|---|
| IUPAC Name | 2,2'-((4R,10S,13S,16S,19S,22S,28S,31S,34S,37R)-37-amino-34-((S)-sec-butyl)-4-carboxy-22-(2-carboxyethyl)-16,31-bis((R)-1-hydroxyethyl)-10-(hydroxymethyl)-19,38,38-trimethyl-6,9,12,15,18,21,24,27,30,33,36-undecaoxo-1,2-dithia-5,8,11,14,17,20,23,26,29,32,35-undecaazacyclooctatriacontane-13,28-diyl)diacetic acid--acetic acid (1/1) |
| Molecular Formula | C45H72N12O22S2.C2H4O2 |
| Molecular Weight | 1256.45 |
| SMILES | CC[C@H](C)[C@]1(C(N[C@@]([H])([C@@H](C)O)C(N[C@@H](CC(O)=O)C(NCC(N[C@@H](CCC(O)=O)C(N[C@@H](C)C(N[C@@]([H])([C@@H](C)O)C(N[C@@H](CC(O)=O)C(N[C@@H](CO)C(NCC(N[C@H](C(O)=O)CSSC([C@H](N)C(N1)=O)(C)C)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)[H].CC(O)=O |
| InChI Key | ITGCCNPESKKMMI-RXICPRDOSA-N |
(S)-5-(((1R,4S,7S,10S,13S,16R,19S,22S,25R,32S,38R)-10-(2-amino-2-oxoethyl)-38-(((S)-1-carboxy-3-methylbutyl)carbamoyl)-22-(2-carboxyethyl)-32-((R)-1-hydroxyethyl)-19-isobutyl-7,13-diisopropyl-4-methyl-3,6,9,12,15,18,21,24,30,33,36-undecaoxo-27,28,40,41-tetrathia-2,5,8,11,14,17,20,23,31,34,37-undecaazabicyclo[14.13.13]dotetracontan-25-yl)amino)-4-((S)-3-carboxy-2-((S)-2,4-diamino-4-oxobutanamido)propanamido)-5-oxopentanoic acid--acetic acid (1/1)
(S)-5-(((1R,4S,7S,10S,13S,16R,19S,22S,25R,32S,38R)-10-(2-Amino-2-oxoethyl)-38-(((S)-1-carboxy-3-methylbutyl)carbamoyl)-22-(2-carboxyethyl)-32-((R)-1-hydroxyethyl)-19-isobutyl-7,13-diisopropyl-4-methyl-3,6,9,12,15,18,21,24,30,33,36-undecaoxo-27,28,40,41-tetrathia-2,5,8,11,14,17,20,23,31,34,37-undecaazabicyclo[14.13.13]dotetracontan-25-yl)amino)-4-((S)-3-carboxy-2-((S)-2,4-diamino-4-oxobutanamido)propanamido)-5-oxopentanoic acid