Account 2,2'-(90-(2-amino-2-oxoethyl)-112-(3-amino-3-oxopropyl)-32,50,75-tris(4-aminobutyl)-84-benzyl-44-(sec-butyl)-72-((1-carboxy-3-methylbutyl)carbamoyl)-109-(2-carboxyethyl)-3,29,41-tris(3-guanidinopropyl)-9-(1-hydroxyethyl)-12,87-bis(hydroxymethyl)-53,78,81-triisobutyl-26-isopropyl-23,38,103-trimethyl-97-(4-(methylthio)-2-(1-(valylprolylisoleucyltyrosylglutamyllysyllysyltyrosylglycylglutaminylvalyl)pyrrolidine-2-carboxamido)butanamido)-1,4,7,10,13,21,24,27,30,33,36,39,42,45,48,51,54,57,60,63,74,77,80,83,86,89,92,98,101,104,107,110,113-tritriacontaoxotetrahexacontahydro-19H-20,56-(epiminoethanoiminoethanoiminoethanoiminoethanoiminoethanoiminopropanodithiomethano)-62,15-(methanodithioethanoiminoethanoiminoethanoiminoethanoiminoethanoiminoethanoiminoethanoiminomethano)pyrrolo[2,1-s][1,2]dithia[5,8,11,14,17,20,23,26,29,32,35,38,41,44,47,50,53,56,59,62]icosaazacyclopentahexacontine-59,100-diyl)diacetic acid
- Catalog No. :
- ACBPWY165
- CAS No. :
- 214050-22-3
- Molecular Formula :
- C225H365N65O65S7
- Molecular Weight :
- 5245.25
IUPAC Name:2,2'-(90-(2-amino-2-oxoethyl)-112-(3-amino-3-oxopropyl)-32,50,75-tris(4-aminobutyl)-84-benzyl-44-(sec-butyl)-72-((1-carboxy-3-methylbutyl)carbamoyl)-109-(2-carboxyethyl)-3,29,41-tris(3-guanidinopropyl)-9-(1-hydroxyethyl)-12,87-bis(hydroxymethyl)-53,78,81-triisobutyl-26-isopropyl-23,38,103-trimethyl-97-(4-(methylthio)-2-(1-(valylprolylisoleucyltyrosylglutamyllysyllysyltyrosylglycylglutaminylvalyl)pyrrolidine-2-carboxamido)butanamido)-1,4,7,10,13,21,24,27,30,33,36,39,42,45,48,51,54,57,60,63,74,77,80,83,86,89,92,98,101,104,107,110,113-tritriacontaoxotetrahexacontahydro-19H-20,56-(epiminoethanoiminoethanoiminoethanoiminoethanoiminoethanoiminopropanodithiomethano)-62,15-(methanodithioethanoiminoethanoiminoethanoiminoethanoiminoethanoiminoethanoiminoethanoiminomethano)pyrrolo[2,1-s][1,2]dithia[5,8,11,14,17,20,23,26,29,32,35,38,41,44,47,50,53,56,59,62]icosaazacyclopentahexacontine-59,100-diyl)diacetic acid
![2,2'-(90-(2-amino-2-oxoethyl)-112-(3-amino-3-oxopropyl)-32,50,75-tris(4-aminobutyl)-84-benzyl-44-(sec-butyl)-72-((1-carboxy-3-methylbutyl)carbamoyl)-109-(2-carboxyethyl)-3,29,41-tris(3-guanidinopropyl)-9-(1-hydroxyethyl)-12,87-bis(hydroxymethyl)-53,78,81-triisobutyl-26-isopropyl-23,38,103-trimethyl-97-(4-(methylthio)-2-(1-(valylprolylisoleucyltyrosylglutamyllysyllysyltyrosylglycylglutaminylvalyl)pyrrolidine-2-carboxamido)butanamido)-1,4,7,10,13,21,24,27,30,33,36,39,42,45,48,51,54,57,60,63,74,77,80,83,86,89,92,98,101,104,107,110,113-tritriacontaoxotetrahexacontahydro-19H-20,56-(epiminoethanoiminoethanoiminoethanoiminoethanoiminoethanoiminopropanodithiomethano)-62,15-(methanodithioethanoiminoethanoiminoethanoiminoethanoiminoethanoiminoethanoiminoethanoiminomethano)pyrrolo[2,1-s][1,2]dithia[5,8,11,14,17,20,23,26,29,32,35,38,41,44,47,50,53,56,59,62]icosaazacyclopentahexacontine-59,100-diyl)diacetic acid structure diagram](/images/productimg/no-pic.svg)
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| Product Name | 2,2'-(90-(2-amino-2-oxoethyl)-112-(3-amino-3-oxopropyl)-32,50,75-tris(4-aminobutyl)-84-benzyl-44-(sec-butyl)-72-((1-carboxy-3-methylbutyl)carbamoyl)-109-(2-carboxyethyl)-3,29,41-tris(3-guanidinopropyl)-9-(1-hydroxyethyl)-12,87-bis(hydroxymethyl)-53,78,81-triisobutyl-26-isopropyl-23,38,103-trimethyl-97-(4-(methylthio)-2-(1-(valylprolylisoleucyltyrosylglutamyllysyllysyltyrosylglycylglutaminylvalyl)pyrrolidine-2-carboxamido)butanamido)-1,4,7,10,13,21,24,27,30,33,36,39,42,45,48,51,54,57,60,63,74,77,80,83,86,89,92,98,101,104,107,110,113-tritriacontaoxotetrahexacontahydro-19H-20,56-(epiminoethanoiminoethanoiminoethanoiminoethanoiminoethanoiminopropanodithiomethano)-62,15-(methanodithioethanoiminoethanoiminoethanoiminoethanoiminoethanoiminoethanoiminoethanoiminomethano)pyrrolo[2,1-s][1,2]dithia[5,8,11,14,17,20,23,26,29,32,35,38,41,44,47,50,53,56,59,62]icosaazacyclopentahexacontine-59,100-diyl)diacetic acid |
|---|---|
| IUPAC Name | 2,2'-(90-(2-amino-2-oxoethyl)-112-(3-amino-3-oxopropyl)-32,50,75-tris(4-aminobutyl)-84-benzyl-44-(sec-butyl)-72-((1-carboxy-3-methylbutyl)carbamoyl)-109-(2-carboxyethyl)-3,29,41-tris(3-guanidinopropyl)-9-(1-hydroxyethyl)-12,87-bis(hydroxymethyl)-53,78,81-triisobutyl-26-isopropyl-23,38,103-trimethyl-97-(4-(methylthio)-2-(1-(valylprolylisoleucyltyrosylglutamyllysyllysyltyrosylglycylglutaminylvalyl)pyrrolidine-2-carboxamido)butanamido)-1,4,7,10,13,21,24,27,30,33,36,39,42,45,48,51,54,57,60,63,74,77,80,83,86,89,92,98,101,104,107,110,113-tritriacontaoxotetrahexacontahydro-19H-20,56-(epiminoethanoiminoethanoiminoethanoiminoethanoiminoethanoiminopropanodithiomethano)-62,15-(methanodithioethanoiminoethanoiminoethanoiminoethanoiminoethanoiminoethanoiminoethanoiminomethano)pyrrolo[2,1-s][1,2]dithia[5,8,11,14,17,20,23,26,29,32,35,38,41,44,47,50,53,56,59,62]icosaazacyclopentahexacontine-59,100-diyl)diacetic acid |
| MDL No. | MFCD01865991 |
| Molecular Formula | C225H365N65O65S7 |
| Molecular Weight | 5245.25 |
| SMILES | CCC(C)C1NC(=O)C(CCCNC(=N)N)NC(=O)C(C)NC(=O)CNC(=O)C(CCCCN)NC(=O)C(CCCNC(=N)N)NC(=O)C(C(C)C)NC(=O)C(C)NC(=O)C2CSSCC3NC(=O)C(CO)NC(=O)C(C(C)O)NC(=O)CNC(=O)C(CCCNC(=N)N)NC(=O)C4CCCN4C(=O)C(CSSCC(C(=O)NC(CC(C)C)C(=O)O)NC(=O)C(CCCCN)NC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)C(CC4=CC=CC=C4)NC(=O)C(CO)NC(=O)C(CC(N)=O)NC3=O)NC(=O)C(CC(=O)O)NC(=O)C(CSSCC(NC(=O)C(CCSC)NC(=O)C3CCCN3C(=O)C(NC(=O)C(CCC(N)=O)NC(=O)CNC(=O)C(CC3=CC=C(O)C=C3)NC(=O)C(CCCCN)NC(=O)C(CCCCN)NC(=O)C(CCC(=O)O)NC(=O)C(CC3=CC=C(O)C=C3)NC(=O)C(NC(=O)C3CCCN3C(=O)C(N)C(C)C)C(C)CC)C(C)C)C(=O)NC(CC(=O)O)C(=O)NC(C)C(=O)NCC(=O)NC(CCC(=O)O)C(=O)NC(CCC(N)=O)C(=O)N2)NC(=O)C(CC(C)C)NC(=O)C(CCCCN)NC(=O)CNC1=O |
| InChI Key | UFCZAYAPDLTVKI-UHFFFAOYSA-N |
| Synonym | CART PEPTIDE (AA 55-102), HUMAN;CART (HUMAN, 55-102);CART (55-102);CART (55-102) (HUMAN);H-VAL-PRO-ILE-TYR-GLU-LYS-LYS-TYR-GLY-GLN-VAL-PRO-MET-CYS-ASP-ALA-GLY-GLU-GLN-CYA-ALA-VAL-ARG-LYS-GLY-ALA-ARG-ILE-GLY-LYS-LEU-CYS-ASP-PRO-ARG-GLY-THR-SER-CYS-ASN-SER-PHELEU-LEU-LYS-CYS-LEU-OH;H-VAL-PRO-ILE-TYR-GLU-LYS-LYS-TYR-GLY-GLN-VAL-PRO-MET-CYS-ASP-ALA-GLY-GLU-GLN-CYS-ALA-VAL-ARG-LYS-GLY-ALA-ARG-ILE-GLY-LYS-LEU-CYS-ASP-CYS-PRO-ARG-GLY-THR-SER-CYS-ASN-SER-PHE-LEU-LEU-LYS-CYS-LEU-OH;H-VAL-PRO-ILE-TYR-GLU-LYS-LYS-TYR-GLY-GLN-VAL-PRO-MET-CYS-ASP-ALA-GLY-GLU-GLN-CYS-ALA-VAL-ARG-LYS-GLY-ALA-ARG-ILE-GLY-LYS-LEU-CYS-ASP-CYS-PRO-ARG-GLY-THR-SER-CYS-ASN-SER-PHE-LEU-LEU-LYS-CYS-LEU-OH (DISULFIDE BRIDGE: 74-94, 68-86, AND 88-101);COCAINE- AND AMPHETAMINE-REGULATED TRANSCRIPT (HUMAN, 55-102) |
| CAS No. | 214050-22-3 |
Synthetic Route by SureRoute
2. ACBPWY165 Molecular Building Block Synthetic Route
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2-((3R,12S,24R,29R,32S,38S,41S,47R,50S,56S,59R,64R,67S,73S,79S,84aS)-64-amino-9,32,67,73-tetrakis(4-aminobutyl)-29-carbamoyl-6,38,41-tris(3-guanidinopropyl)-18-(4-hydroxybenzyl)-12-((R)-1-hydroxyethyl)-50,56-bis(hydroxymethyl)-79-methyl-15-(2-(methylthio)ethyl)-1,4,7,10,13,16,19,22,31,34,37,40,43,46,49,52,55,58,65,68,71,74,77,80,86-pentacosaoxooctaheptacontahydro-1H,28H-59,24-(epiminomethano)-3,47-(methanodithiomethano)pyrrolo[2,1-b1][1,2,48,49]tetrathia[5,8,11,14,17,20,23,26,29,32,35,38,41,44,53,56,59,62,65,68,71,74,77,80]tetracosaazacyclodooctacontin-21-yl)acetic acid
(3S,9S,12S,15S,18S,24R,29R,32S,37aS)-29-amino-32-(2-amino-2-oxoethyl)-15-(4-aminobutyl)-18-(2-carboxyethyl)-9-(4-hydroxybenzyl)-12-((R)-1-hydroxyethyl)-3-(2-(methylthio)ethyl)-1,4,7,10,13,16,19,22,30,33-decaoxotetratriacontahydro-1H-pyrrolo[2,1-b1][1,2]dithia[5,8,11,14,17,20,23,26,29,32]decaazacyclopentatriacontine-24-carboxylic acid