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Details

Stereochemistry ABSOLUTE
Molecular Formula C19H36N2O6S.ClH
Molecular Weight 457.025
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1'-DEMETHYL-1'-ETHYLLINCOMYCIN HYDROCHLORIDE ANHYDROUS

SMILES

Cl.[H][C@@](NC(=O)[C@@H]1C[C@@H](CCC)CN1CC)([C@@H](C)O)[C@@]2([H])O[C@H](SC)[C@H](O)[C@@H](O)[C@H]2O

InChI

InChIKey=YQSIAUAYRVARII-APALSABDSA-N
InChI=1S/C19H36N2O6S.ClH/c1-5-7-11-8-12(21(6-2)9-11)18(26)20-13(10(3)22)17-15(24)14(23)16(25)19(27-17)28-4;/h10-17,19,22-25H,5-9H2,1-4H3,(H,20,26);1H/t10-,11-,12+,13-,14+,15-,16-,17-,19-;/m1./s1

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C19H36N2O6S
Molecular Weight 420.564
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 9 / 9
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 13:43:59 GMT 2023
Edited
by admin
on Sat Dec 16 13:43:59 GMT 2023
Record UNII
OT6UA7UN7M
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1'-DEMETHYL-1'-ETHYLLINCOMYCIN HYDROCHLORIDE ANHYDROUS
Common Name English
N-HOMOLINCOMYCIN HYDROCHLORIDE ANHYDROUS
Common Name English
D-ERYTHRO-D-GALACTO-OCTOPYRANOSIDE, METHYL 6,8-DIDEOXY-6-(1-ETHYL-4-PROPYL-L-2-PYRROLIDINECARBOXAMIDO)-1-THIO-, MONOHYDROCHLORIDE, TRANS-.ALPHA.-
Systematic Name English
Code System Code Type Description
CAS
14600-63-6
Created by admin on Sat Dec 16 13:43:59 GMT 2023 , Edited by admin on Sat Dec 16 13:43:59 GMT 2023
PRIMARY
FDA UNII
OT6UA7UN7M
Created by admin on Sat Dec 16 13:43:59 GMT 2023 , Edited by admin on Sat Dec 16 13:43:59 GMT 2023
PRIMARY
PUBCHEM
133083089
Created by admin on Sat Dec 16 13:43:59 GMT 2023 , Edited by admin on Sat Dec 16 13:43:59 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
SOLVATE->ANHYDROUS