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Details

Stereochemistry ABSOLUTE
Molecular Formula C34H51N5O13
Molecular Weight 737.7944
Optical Activity UNSPECIFIED
Defined Stereocenters 10 / 10
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of RS-118641

SMILES

CCCCCCCCCC(=O)O[C@@H]1[C@H](OC)[C@H](O[C@H]1N2C=CC(=O)NC2=O)[C@@H](O[C@H]3OC(=C[C@H](O)[C@@H]3O)C(=O)N[C@H]4CCC[C@@H](C)NC4=O)C(N)=O

InChI

InChIKey=MTVCVDHANKHRCR-MNJNIPBHSA-N
InChI=1S/C34H51N5O13/c1-4-5-6-7-8-9-10-14-23(42)50-28-25(48-3)26(51-32(28)39-16-15-22(41)38-34(39)47)27(29(35)44)52-33-24(43)20(40)17-21(49-33)31(46)37-19-13-11-12-18(2)36-30(19)45/h15-20,24-28,32-33,40,43H,4-14H2,1-3H3,(H2,35,44)(H,36,45)(H,37,46)(H,38,41,47)/t18-,19+,20+,24+,25-,26+,27-,28-,32-,33-/m1/s1

HIDE SMILES / InChI

Molecular Formula C34H51N5O13
Molecular Weight 737.7944
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 10 / 10
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

PubMed

PubMed

TitleDatePubMed
Activity of capuramycin analogues against Mycobacterium tuberculosis, Mycobacterium avium and Mycobacterium intracellulare in vitro and in vivo.
2004-10
Patents

Patents

Substance Class Chemical
Created
by admin
on Mon Mar 31 21:41:32 GMT 2025
Edited
by admin
on Mon Mar 31 21:41:32 GMT 2025
Record UNII
49D8WPZ5YL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
RS-118641
Common Name English
SQ-641
Preferred Name English
.ALPHA.-L-TALOFURANURONAMIDE, 1-DEOXY-5-O-(4-DEOXY-N-((3S,7R)-HEXAHYDRO-7-METHYL-2-OXO-1H-AZEPIN-3-YL)-.BETA.-L-ERYTHRO-HEX-4-ENOPYRANURONAMIDOSYL)-1-(3,4-DIHYDRO-2,4-DIOXO-1(2H)-PYRIMIDINYL)-3-O-METHYL-, 2-DECANOATE
Systematic Name English
Code System Code Type Description
PUBCHEM
3013049
Created by admin on Mon Mar 31 21:41:32 GMT 2025 , Edited by admin on Mon Mar 31 21:41:32 GMT 2025
PRIMARY
FDA UNII
49D8WPZ5YL
Created by admin on Mon Mar 31 21:41:32 GMT 2025 , Edited by admin on Mon Mar 31 21:41:32 GMT 2025
PRIMARY
CAS
254449-23-5
Created by admin on Mon Mar 31 21:41:32 GMT 2025 , Edited by admin on Mon Mar 31 21:41:32 GMT 2025
PRIMARY
Related Record Type Details
ACTIVE MOIETY