ASUDEMOTIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C58H80N10O17
Molecular Weight	1189.3126
Optical Activity	UNSPECIFIED
Defined Stereocenters	10 / 10
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC2=CC=C(O)C=C2)NC(=O)[C@H](CC3=CC=C(O)C=C3)NC(=O)[C@@H](N)CCC(O)=O)C(C)C)C(O)=O

InChI

InChIKey=FIURBSUJWCYXNV-OXOWVKQUSA-N

InChI=1S/C58H80N10O17/c1-7-32(6)49(58(84)85)68-56(82)44(29-45(60)71)66-57(83)48(31(4)5)67-55(81)43(26-33-11-9-8-10-12-33)65-52(78)40(25-30(2)3)63-51(77)39(22-24-47(74)75)61-53(79)42(28-35-15-19-37(70)20-16-35)64-54(80)41(27-34-13-17-36(69)18-14-34)62-50(76)38(59)21-23-46(72)73/h8-20,30-32,38-44,48-49,69-70H,7,21-29,59H2,1-6H3,(H2,60,71)(H,61,79)(H,62,76)(H,63,77)(H,64,80)(H,65,78)(H,66,83)(H,67,81)(H,68,82)(H,72,73)(H,74,75)(H,84,85)/t32-,38-,39-,40-,41-,42-,43-,44-,48-,49-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C58H80N10O17
Molecular Weight	1189.3126
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	10 / 10
E/Z Centers	1
Optical Activity	UNSPECIFIED

Description
Sources: https://www.ncbi.nlm.nih.gov/pubmed/30058598 | https://upload.umin.ac.jp/cgi-open-bin/ctr_e/ctr_view.cgi?recptno=R000019678 | https://upload.umin.ac.jp/cgi-open-bin/ctr_e/ctr_view.cgi?recptno=R000015815

Asudemotide, also known as S-588410, an immunostimulant that was studied as adjuvant therapy in phase III clinical trials for patients with esophageal cancer. In addition, this drug participated in phase II clinical trials after first-line chemotherapy in patients with advanced and/or metastatic bladder cancer.

Originator

Approval Year

PubMed

Title	Date	PubMed
Immunotherapy for esophageal squamous cell carcinoma: a review.	2018 Aug 29	30058598

Sample Use Guides

In Vivo Use Guide

S-588410 (Asudemotide) will be injected subcutaneously once weekly for 12 weeks and once every 2 weeks thereafter for 94 weeks.

Route of Administration: Other

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:09:33 GMT 2023` Edited by `admin` on `Sat Dec 16 08:09:33 GMT 2023`
Record UNII	30Q33TZ6A7
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ASUDEMOTIDE

Official Name

English

L-ISOLEUCINE, L-.ALPHA.-GLUTAMYL-L-TYROSYL-L-TYROSYL-L-.ALPHA.-GLUTAMYL-L-LEUCYL-L-PHENYLALANYL-L-VALYL-L-ASPARAGINYL-

Systematic Name

English

HUMAN DEP DOMAIN-CONTAINING PROTEIN 1A-(294-302)-PEPTIDE

Common Name

English

asudemotide [INN]

Common Name

English

GLU-TYR-TYR-GLU-LEU-PHE-VAL-ASN-ILE

Systematic Name

English

Code System Code Type Description

INN

9593