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Details

Stereochemistry ABSOLUTE
Molecular Formula C41H67NO15
Molecular Weight 813.9684
Optical Activity UNSPECIFIED
Defined Stereocenters 16 / 16
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of LEUCOMYCIN A4

SMILES

[H][C@@]2(O[C@H]1[C@@H](CC=O)C[C@@H](C)[C@@H](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)CCC)[C@H](C)O3)[C@@H]([C@H]2O)N(C)C

InChI

InChIKey=XVTMRUKLMXPAKO-RXUUKHTDSA-N
InChI=1S/C41H67NO15/c1-11-15-31(46)55-39-26(5)52-33(22-41(39,7)49)56-36-25(4)53-40(35(48)34(36)42(8)9)57-37-28(18-19-43)20-23(2)29(45)17-14-12-13-16-24(3)51-32(47)21-30(38(37)50-10)54-27(6)44/h12-14,17,19,23-26,28-30,33-40,45,48-49H,11,15-16,18,20-22H2,1-10H3/b13-12+,17-14+/t23-,24-,25-,26+,28+,29+,30-,33+,34-,35-,36-,37+,38+,39+,40+,41-/m1/s1

HIDE SMILES / InChI

Molecular Formula C41H67NO15
Molecular Weight 813.9684
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 07:39:32 GMT 2023
Edited
by admin
on Sat Dec 16 07:39:32 GMT 2023
Record UNII
BP88W7ZP3A
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
LEUCOMYCIN A4
Common Name English
KITASAMYCIN A4
Common Name English
LEUCOMYCIN V, 3-ACETATE 4B-BUTANOATE
Common Name English
Code System Code Type Description
CAS
18361-46-1
Created by admin on Sat Dec 16 07:39:32 GMT 2023 , Edited by admin on Sat Dec 16 07:39:32 GMT 2023
PRIMARY
PUBCHEM
5282323
Created by admin on Sat Dec 16 07:39:32 GMT 2023 , Edited by admin on Sat Dec 16 07:39:32 GMT 2023
PRIMARY
FDA UNII
BP88W7ZP3A
Created by admin on Sat Dec 16 07:39:32 GMT 2023 , Edited by admin on Sat Dec 16 07:39:32 GMT 2023
PRIMARY
EPA CompTox
DTXSID501317663
Created by admin on Sat Dec 16 07:39:32 GMT 2023 , Edited by admin on Sat Dec 16 07:39:32 GMT 2023
PRIMARY