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

Details

Stereochemistry ABSOLUTE
Molecular Formula C36H67ClN2O6S
Molecular Weight 691.445
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CLINDAMYCIN STEARATE

SMILES

[H][C@@](NC(=O)[C@@H]1C[C@@H](CCC)CN1C)([C@H](C)Cl)[C@@]2([H])O[C@H](SC)[C@H](OC(=O)CCCCCCCCCCCCCCCCC)[C@@H](O)[C@H]2O

InChI

InChIKey=QYWAENWZQGVWKH-DKTQTCLQSA-N
InChI=1S/C36H67ClN2O6S/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23-29(40)44-34-32(42)31(41)33(45-36(34)46-5)30(26(3)37)38-35(43)28-24-27(22-7-2)25-39(28)4/h26-28,30-34,36,41-42H,6-25H2,1-5H3,(H,38,43)/t26-,27+,28-,30+,31+,32-,33+,34+,36+/m0/s1

HIDE SMILES / InChI

Molecular Formula C36H67ClN2O6S
Molecular Weight 691.445
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 11:09:24 GMT 2023
Edited
by admin
on Sat Dec 16 11:09:24 GMT 2023
Record UNII
XNC66D9G6G
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CLINDAMYCIN STEARATE
Common Name English
L-THREO-.ALPHA.-D-GALACTO-OCTOPYRANOSIDE, METHYL 7-CHLORO-6,7,8-TRIDEOXY-6-((((2S,4R)-1-METHYL-4-PROPYL-2-PYRROLIDINYL)CARBONYL)AMINO)-1-THIO-, 2-OCTADECANOATE
Systematic Name English
Code System Code Type Description
FDA UNII
XNC66D9G6G
Created by admin on Sat Dec 16 11:09:24 GMT 2023 , Edited by admin on Sat Dec 16 11:09:24 GMT 2023
PRIMARY
CAS
1123211-70-0
Created by admin on Sat Dec 16 11:09:24 GMT 2023 , Edited by admin on Sat Dec 16 11:09:24 GMT 2023
PRIMARY
PUBCHEM
131865976
Created by admin on Sat Dec 16 11:09:24 GMT 2023 , Edited by admin on Sat Dec 16 11:09:24 GMT 2023
PRIMARY