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Details

Stereochemistry ABSOLUTE
Molecular Formula C37H61NO13
Molecular Weight 727.8791
Optical Activity UNSPECIFIED
Defined Stereocenters 17 / 17
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MIROSAMICIN

SMILES

[H][C@@]12O[C@@]1([H])[C@](O)(CO[C@@H]3O[C@H](C)[C@@H](O)[C@@H](OC)[C@H]3OC)[C@@H](CC)OC(=O)\C=C\[C@H](C)[C@@H](O[C@]4([H])O[C@H](C)C[C@@H]([C@H]4O)N(C)C)[C@@H](C)C[C@@H](C)C(=O)\C=C\2

InChI

InChIKey=WWIDEZOUVSJVHS-ZPQCYHEESA-N
InChI=1S/C37H61NO13/c1-11-27-37(43,18-46-36-33(45-10)32(44-9)29(41)23(6)48-36)34-26(49-34)14-13-25(39)20(3)16-21(4)31(19(2)12-15-28(40)50-27)51-35-30(42)24(38(7)8)17-22(5)47-35/h12-15,19-24,26-27,29-36,41-43H,11,16-18H2,1-10H3/b14-13+,15-12+/t19-,20+,21-,22+,23+,24-,26-,27+,29+,30+,31+,32+,33+,34+,35-,36+,37-/m0/s1

HIDE SMILES / InChI

Molecular Formula C37H61NO13
Molecular Weight 727.8791
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 17 / 17
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:44:01 GMT 2023
Edited
by admin
on Fri Dec 15 15:44:01 GMT 2023
Record UNII
K7G02HKM1X
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MIROSAMICIN
INN  
INN  
Official Name English
mirosamicin [INN]
Common Name English
14-HYDROXYMYCINAMICIN I
Common Name English
MIROSAMICIN [JAN]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C261
Created by admin on Fri Dec 15 15:44:01 GMT 2023 , Edited by admin on Fri Dec 15 15:44:01 GMT 2023
Code System Code Type Description
EPA CompTox
DTXSID801024536
Created by admin on Fri Dec 15 15:44:01 GMT 2023 , Edited by admin on Fri Dec 15 15:44:01 GMT 2023
PRIMARY
MESH
C063027
Created by admin on Fri Dec 15 15:44:01 GMT 2023 , Edited by admin on Fri Dec 15 15:44:01 GMT 2023
PRIMARY
INN
6178
Created by admin on Fri Dec 15 15:44:01 GMT 2023 , Edited by admin on Fri Dec 15 15:44:01 GMT 2023
PRIMARY
EVMPD
SUB08995MIG
Created by admin on Fri Dec 15 15:44:01 GMT 2023 , Edited by admin on Fri Dec 15 15:44:01 GMT 2023
PRIMARY
PUBCHEM
6917042
Created by admin on Fri Dec 15 15:44:01 GMT 2023 , Edited by admin on Fri Dec 15 15:44:01 GMT 2023
PRIMARY
CAS
73684-69-2
Created by admin on Fri Dec 15 15:44:01 GMT 2023 , Edited by admin on Fri Dec 15 15:44:01 GMT 2023
PRIMARY
NCI_THESAURUS
C90878
Created by admin on Fri Dec 15 15:44:01 GMT 2023 , Edited by admin on Fri Dec 15 15:44:01 GMT 2023
PRIMARY
SMS_ID
100000080667
Created by admin on Fri Dec 15 15:44:01 GMT 2023 , Edited by admin on Fri Dec 15 15:44:01 GMT 2023
PRIMARY
FDA UNII
K7G02HKM1X
Created by admin on Fri Dec 15 15:44:01 GMT 2023 , Edited by admin on Fri Dec 15 15:44:01 GMT 2023
PRIMARY
ChEMBL
CHEMBL2106434
Created by admin on Fri Dec 15 15:44:01 GMT 2023 , Edited by admin on Fri Dec 15 15:44:01 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY