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Details

Stereochemistry ABSOLUTE
Molecular Formula C66H87N13O13
Molecular Weight 1270.4763
Optical Activity UNSPECIFIED
Defined Stereocenters 10 / 10
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TYROCIDINE A

SMILES

CC(C)C[C@@H]1NC(=O)[C@H](CCCN)NC(=O)[C@@H](NC(=O)[C@H](CC2=CC=C(O)C=C2)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](CC3=CC=CC=C3)NC(=O)[C@H](CC4=CC=CC=C4)NC(=O)[C@@H]5CCCN5C(=O)[C@@H](CC6=CC=CC=C6)NC1=O)C(C)C

InChI

InChIKey=GSXRBRIWJGAPDU-BBVRJQLQSA-N
InChI=1S/C66H87N13O13/c1-38(2)32-47-59(85)77-52(36-42-20-12-7-13-21-42)66(92)79-31-15-23-53(79)64(90)76-49(34-41-18-10-6-11-19-41)61(87)74-48(33-40-16-8-5-9-17-40)60(86)75-51(37-55(69)82)62(88)70-46(28-29-54(68)81)58(84)73-50(35-43-24-26-44(80)27-25-43)63(89)78-56(39(3)4)65(91)71-45(22-14-30-67)57(83)72-47/h5-13,16-21,24-27,38-39,45-53,56,80H,14-15,22-23,28-37,67H2,1-4H3,(H2,68,81)(H2,69,82)(H,70,88)(H,71,91)(H,72,83)(H,73,84)(H,74,87)(H,75,86)(H,76,90)(H,77,85)(H,78,89)/t45-,46-,47-,48+,49-,50-,51-,52+,53-,56-/m0/s1

HIDE SMILES / InChI

Molecular Formula C66H87N13O13
Molecular Weight 1270.4763
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 10 / 10
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:18:53 UTC 2023
Edited
by admin
on Sat Dec 16 08:18:53 UTC 2023
Record UNII
V134656H89
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TYROCIDINE A
MI  
Common Name English
STREPTOCIDIN O
Brand Name English
TYROCIDINE A [MI]
Common Name English
CYCLO(L-ASPARAGINYL-L-GLUTAMINYL-L-TYROSYL-L-VALYL-L-ORNITHYL-L-LEUCYL-D-PHENYLALANYL-L-PROLYL-L-PHENYLALANYL-D-PHENYLALANYL)
Common Name English
TYROCIDIN A
Common Name English
Code System Code Type Description
FDA UNII
V134656H89
Created by admin on Sat Dec 16 08:18:53 UTC 2023 , Edited by admin on Sat Dec 16 08:18:53 UTC 2023
PRIMARY
EPA CompTox
DTXSID40163885
Created by admin on Sat Dec 16 08:18:53 UTC 2023 , Edited by admin on Sat Dec 16 08:18:53 UTC 2023
PRIMARY
CAS
1481-70-5
Created by admin on Sat Dec 16 08:18:53 UTC 2023 , Edited by admin on Sat Dec 16 08:18:53 UTC 2023
PRIMARY
CHEBI
29701
Created by admin on Sat Dec 16 08:18:53 UTC 2023 , Edited by admin on Sat Dec 16 08:18:53 UTC 2023
PRIMARY
PUBCHEM
16129635
Created by admin on Sat Dec 16 08:18:53 UTC 2023 , Edited by admin on Sat Dec 16 08:18:53 UTC 2023
PRIMARY
MERCK INDEX
m11287
Created by admin on Sat Dec 16 08:18:53 UTC 2023 , Edited by admin on Sat Dec 16 08:18:53 UTC 2023
PRIMARY Merck Index