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

Details

Stereochemistry ABSOLUTE
Molecular Formula C33H61ClN2O6S
Molecular Weight 649.365
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CLINDAMYCIN PENTADECANOATE

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)CCCCCCCCCCCCCC)[C@@H](O)[C@H]2O

InChI

InChIKey=YQVJBMURKHNOBB-VYUCIWTASA-N
InChI=1S/C33H61ClN2O6S/c1-6-8-9-10-11-12-13-14-15-16-17-18-20-26(37)41-31-29(39)28(38)30(42-33(31)43-5)27(23(3)34)35-32(40)25-21-24(19-7-2)22-36(25)4/h23-25,27-31,33,38-39H,6-22H2,1-5H3,(H,35,40)/t23-,24+,25-,27+,28+,29-,30+,31+,33+/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
CLINDAMYCIN PENTADECANOATE
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-PENTADECANOATE
Systematic Name English
Code System Code Type Description
FDA UNII
U7UWD5EG47
Created by admin on Sat Dec 16 11:26:45 UTC 2023 , Edited by admin on Sat Dec 16 11:26:45 UTC 2023
PRIMARY
CAS
1123211-67-5
Created by admin on Sat Dec 16 11:26:45 UTC 2023 , Edited by admin on Sat Dec 16 11:26:45 UTC 2023
PRIMARY
PUBCHEM
156614159
Created by admin on Sat Dec 16 11:26:45 UTC 2023 , Edited by admin on Sat Dec 16 11:26:45 UTC 2023
PRIMARY