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Details

Stereochemistry ABSOLUTE
Molecular Formula C19H35ClN2O5S.ClH
Molecular Weight 475.471
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MIRINCAMYCIN HYDROCHLORIDE, (2S-CIS)-

SMILES

Cl.CCCCC[C@@H]1CN[C@@H](C1)C(=O)N[C@H]([C@H](C)Cl)[C@H]2O[C@H](SC)[C@H](O)[C@@H](O)[C@H]2O

InChI

InChIKey=YQEJFKZIXMSIBY-SXGIMHKGSA-N
InChI=1S/C19H35ClN2O5S.ClH/c1-4-5-6-7-11-8-12(21-9-11)18(26)22-13(10(2)20)17-15(24)14(23)16(25)19(27-17)28-3;/h10-17,19,21,23-25H,4-9H2,1-3H3,(H,22,26);1H/t10-,11-,12-,13+,14-,15+,16+,17+,19+;/m0./s1

HIDE SMILES / InChI

Molecular Formula C19H35ClN2O5S
Molecular Weight 439.01
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 9 / 9
E/Z Centers 0
Optical Activity UNSPECIFIED

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

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 23:13:07 GMT 2025
Edited
by admin
on Mon Mar 31 23:13:07 GMT 2025
Record UNII
LN38B30P7T
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
L-THREO-.ALPHA.-D-GALACTO-OCTOPYRANOSIDE, METHYL 7-CHLORO-6,7,8-TRIDEOXY-6-(((4-PENTYL-2-PYRROLIDINYL)CARBONYL)AMINO)-1-THIO-, MONOHYDROCHLORIDE, (2S-CIS)-
Preferred Name English
MIRINCAMYCIN HYDROCHLORIDE, (2S-CIS)-
Common Name English
Code System Code Type Description
FDA UNII
LN38B30P7T
Created by admin on Mon Mar 31 23:13:07 GMT 2025 , Edited by admin on Mon Mar 31 23:13:07 GMT 2025
PRIMARY
CAS
33054-87-4
Created by admin on Mon Mar 31 23:13:07 GMT 2025 , Edited by admin on Mon Mar 31 23:13:07 GMT 2025
PRIMARY
EPA CompTox
DTXSID401350418
Created by admin on Mon Mar 31 23:13:07 GMT 2025 , Edited by admin on Mon Mar 31 23:13:07 GMT 2025
PRIMARY
PUBCHEM
86280474
Created by admin on Mon Mar 31 23:13:07 GMT 2025 , Edited by admin on Mon Mar 31 23:13:07 GMT 2025
PRIMARY