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Details

Stereochemistry ABSOLUTE
Molecular Formula C44H69NO17
Molecular Weight 884.0152
Optical Activity UNSPECIFIED
Defined Stereocenters 16 / 16
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of LEUCOMYCIN A6 ACETATE

SMILES

[H][C@@]2(O[C@H]1[C@@H](CC=O)C[C@@H](C)[C@@H](OC(C)=O)\C=C\C=C\C[C@@H](C)OC(=O)C[C@@H](OC(C)=O)[C@@H]1OC)O[C@H](C)[C@@]([H])(O[C@H]3C[C@@](C)(O)[C@@H](OC(=O)CC)[C@H](C)O3)[C@@H]([C@H]2OC(C)=O)N(C)C

InChI

InChIKey=CLROXSMRUGVWIT-WNWCIUCGSA-N
InChI=1S/C44H69NO17/c1-13-34(50)60-42-27(5)55-36(23-44(42,9)52)61-38-26(4)56-43(41(59-30(8)49)37(38)45(10)11)62-39-31(19-20-46)21-24(2)32(57-28(6)47)18-16-14-15-17-25(3)54-35(51)22-33(40(39)53-12)58-29(7)48/h14-16,18,20,24-27,31-33,36-43,52H,13,17,19,21-23H2,1-12H3/b15-14+,18-16+/t24-,25-,26-,27+,31+,32+,33-,36+,37+,38-,39+,40+,41-,42+,43+,44-/m1/s1

HIDE SMILES / InChI

Molecular Formula C44H69NO17
Molecular Weight 884.0152
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 16 / 16
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 01:12:16 GMT 2023
Edited
by admin
on Sat Dec 16 01:12:16 GMT 2023
Record UNII
02TX97A6C0
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
LEUCOMYCIN A6 ACETATE
Common Name English
KITASAMYCIN A6 ACETATE
Common Name English
LEUCOMYCIN A7, TRIACETATE (ESTER)
Common Name English
KITASAMYCIN A7 ACETATE
Common Name English
LEUCOMYCIN A7 ACETATE
Common Name English
(4R,5S,6S,7R,9R,10R,11E,13E,16R)-6-(((2S,3R,4S,5S,6R)-3-ACETOXY-4-(DIMETHYLAMINO)-5-(((2S,4R,5S,6S)-4-HYDROXY-4,6-DIMETHYL-5-(PROPIONYLOXY)TETRAHYDRO-2H-PYRAN-2-YL)OXY)-6-METHYLTETRAHYDRO-2H-PYRAN-2-YL)OXY)-5-METHOXY-9,16-DIMETHYL-2-OXO-7-(2-OXOETHYL)OXA
Systematic Name English
LEUCOMYCIN V, 2(SUP A),3,9-TRIACETATE 4(SUP B)-PROPANOATE
Common Name English
(3R,4R,5S,6R,8R,9R,10E,12E,15R)-3,9-DIACETOXY-5-(4-O-PROPANOYL-2,6-DIDEOXY-3-C-METHYL-.ALPHA.-L-RIBO-HEXOPYRANOSYL-(1->4)-2-O-ACETYL-3,6-DIDEOXY-3-DIMETHYLAMINO-.BETA.-D-GLUCOPYRANOSYLOXY)-6-FORMYLMETHYL-4-METHOXY-8-METHYLHEXADECA-10,12-DIEN-15-OLIDE
Systematic Name English
Code System Code Type Description
FDA UNII
02TX97A6C0
Created by admin on Sat Dec 16 01:12:16 GMT 2023 , Edited by admin on Sat Dec 16 01:12:16 GMT 2023
PRIMARY
PUBCHEM
91617575
Created by admin on Sat Dec 16 01:12:16 GMT 2023 , Edited by admin on Sat Dec 16 01:12:16 GMT 2023
PRIMARY
CAS
22924-74-9
Created by admin on Sat Dec 16 01:12:16 GMT 2023 , Edited by admin on Sat Dec 16 01:12:16 GMT 2023
PRIMARY