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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H37ClN2O5S
Molecular Weight 465.047
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3,4-O-Isopropylidene Clindamycin

SMILES

[H][C@]12OC(C)(C)O[C@@]1([H])[C@]([H])(O[C@H](SC)[C@@H]2O)[C@H](NC(=O)[C@@H]3C[C@@H](CCC)CN3C)[C@H](C)Cl

InChI

InChIKey=HCPHMGDEJJICGS-NQRGRALISA-N
InChI=1S/C21H37ClN2O5S/c1-7-8-12-9-13(24(5)10-12)19(26)23-14(11(2)22)16-18-17(28-21(3,4)29-18)15(25)20(27-16)30-6/h11-18,20,25H,7-10H2,1-6H3,(H,23,26)/t11-,12+,13-,14+,15+,16+,17+,18-,20+/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
3,4-O-Isopropylidene Clindamycin
Common Name English
Methyl 7-chloro-6,7,8-trideoxy-3,4-O-(1-methylethylidene)-6-[[[(2S,4R)-1-methyl-4-propyl-2-pyrrolidinyl]carbonyl]amino]-1-thio-L-threo-α-D-galacto-octopyranoside
Systematic Name English
L-threo-α-D-galacto-Octopyranoside, methyl 7-chloro-6,7,8-trideoxy-3,4-O-(1-methylethylidene)-6-[[(1-methyl-4-propyl-2-pyrrolidinyl)carbonyl]amino]-1-thio-, (2S-trans)-
Systematic Name English
L-threo-α-D-galacto-Octopyranoside, methyl 7-chloro-6,7,8-trideoxy-3,4-O-(1-methylethylidene)-6-[[[(2S,4R)-1-methyl-4-propyl-2-pyrrolidinyl]carbonyl]amino]-1-thio-
Systematic Name English
Clindamycin 3,4-isopropylidene
Common Name English
Code System Code Type Description
PUBCHEM
91872615
Created by admin on Sat Dec 16 20:17:47 GMT 2023 , Edited by admin on Sat Dec 16 20:17:47 GMT 2023
PRIMARY
FDA UNII
D2PA3C3KHX
Created by admin on Sat Dec 16 20:17:47 GMT 2023 , Edited by admin on Sat Dec 16 20:17:47 GMT 2023
PRIMARY
CAS
147650-54-2
Created by admin on Sat Dec 16 20:17:47 GMT 2023 , Edited by admin on Sat Dec 16 20:17:47 GMT 2023
PRIMARY