U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C37H61NO14
Molecular Weight 743.8785
Optical Activity UNSPECIFIED
Defined Stereocenters 16 / 16
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DEISOVALERYL JOSAMYCIN

SMILES

[H][C@@]2(O[C@H]1[C@@H](CC=O)C[C@@H](C)[C@@H](O)\C=C\C=C\C[C@@H](C)OC(=O)C[C@@H](OC(C)=O)[C@@H]1OC)O[C@H](C)[C@@]([H])(O[C@H]3C[C@@](C)(O)[C@@H](O)[C@H](C)O3)[C@@H]([C@H]2O)N(C)C

InChI

InChIKey=VMPKXDLYZIGGMM-MXYURFFASA-N
InChI=1S/C37H61NO14/c1-20-17-25(15-16-39)33(34(46-9)27(50-24(5)40)18-28(42)47-21(2)13-11-10-12-14-26(20)41)52-36-31(43)30(38(7)8)32(22(3)49-36)51-29-19-37(6,45)35(44)23(4)48-29/h10-12,14,16,20-23,25-27,29-36,41,43-45H,13,15,17-19H2,1-9H3/b11-10+,14-12+/t20-,21-,22-,23+,25+,26+,27-,29+,30-,31-,32-,33+,34+,35+,36+,37-/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
DEISOVALERYL JOSAMYCIN
Common Name English
LEUCOMYCIN V, 3-ACETATE
Common Name English
((4R,5S,6S,7R,9R,10R,11E,13E,16R)-6-((2S,3R,4R,5S,6R)-5-((2S,4R,5S,6S)-4,5-DIHYDROXY-4,6-DIMETHYLOXAN-2-YL)OXY-4-(DIMETHYLAMINO)-3-HYDROXY-6-METHYLOXAN-2-YL)OXY-10-HYDROXY-5-METHOXY-9,16-DIMETHYL-2-OXO-7-(2-OXOETHYL)-1-OXACYCLOHEXADECA-11,13-DIEN-4-YL)
Systematic Name English
DEISOVALERYL LEUCOMYCIN A3
Common Name English
4''-DEISOVALERYLJOSAMYCIN
Common Name English
LEUCOMYCIN U
Common Name English
Code System Code Type Description
FDA UNII
FN8M8YK7E7
Created by admin on Sat Dec 16 14:50:57 GMT 2023 , Edited by admin on Sat Dec 16 14:50:57 GMT 2023
PRIMARY
CAS
31642-61-2
Created by admin on Sat Dec 16 14:50:57 GMT 2023 , Edited by admin on Sat Dec 16 14:50:57 GMT 2023
PRIMARY
PUBCHEM
90675211
Created by admin on Sat Dec 16 14:50:57 GMT 2023 , Edited by admin on Sat Dec 16 14:50:57 GMT 2023
PRIMARY