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Details

Stereochemistry ABSOLUTE
Molecular Formula C51H86N2O16
Molecular Weight 983.2323
Optical Activity UNSPECIFIED
Defined Stereocenters 19 / 19
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ISOVALERYLSPIRAMYCIN III

SMILES

CCC(=O)O[C@@H]1CC(=O)O[C@H](C)C\C=C\C=C\[C@H](O[C@H]2CC[C@@H]([C@@H](C)O2)N(C)C)[C@H](C)C[C@H](CC=O)[C@H](O[C@@H]3O[C@H](C)[C@@H](O[C@H]4C[C@@](C)(O)[C@@H](OC(=O)CC(C)C)[C@H](C)O4)[C@@H]([C@H]3O)N(C)C)[C@H]1OC

InChI

InChIKey=GIDHDUYAXIVIMN-JJORJHTQSA-N
InChI=1S/C51H86N2O16/c1-15-39(55)65-38-27-41(57)61-31(5)19-17-16-18-20-37(66-42-22-21-36(52(10)11)32(6)62-42)30(4)26-35(23-24-54)47(48(38)60-14)69-50-45(58)44(53(12)13)46(33(7)64-50)68-43-28-51(9,59)49(34(8)63-43)67-40(56)25-29(2)3/h16-18,20,24,29-38,42-50,58-59H,15,19,21-23,25-28H2,1-14H3/b17-16+,20-18+/t30-,31-,32-,33-,34+,35+,36+,37+,38-,42+,43+,44-,45-,46-,47+,48+,49+,50+,51-/m1/s1

HIDE SMILES / InChI

Molecular Formula C51H86N2O16
Molecular Weight 983.2323
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 19 / 19
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 06:28:32 GMT 2025
Edited
by admin
on Wed Apr 02 06:28:32 GMT 2025
Record UNII
O6EN3F24FY
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ISOVALERYLSPIRAMYCIN III
Common Name English
SHENGJIMYCIN A
Preferred Name English
LEUCOMYCIN V, 9-O-((2R,5S,6R)-5-(DIMETHYLAMINO)TETRAHYDRO-6-METHYL-2H-PYRAN-2-YL)-, 4B-(3-METHYLBUTANOATE) 3-PROPANOATE
Systematic Name English
Code System Code Type Description
PUBCHEM
101485378
Created by admin on Wed Apr 02 06:28:32 GMT 2025 , Edited by admin on Wed Apr 02 06:28:32 GMT 2025
PRIMARY
CAS
212125-76-3
Created by admin on Wed Apr 02 06:28:32 GMT 2025 , Edited by admin on Wed Apr 02 06:28:32 GMT 2025
PRIMARY
FDA UNII
O6EN3F24FY
Created by admin on Wed Apr 02 06:28:32 GMT 2025 , Edited by admin on Wed Apr 02 06:28:32 GMT 2025
PRIMARY