U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C21H41N5O12
Molecular Weight 555.5765
Optical Activity UNSPECIFIED
Defined Stereocenters 15 / 15
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BUTIROSIN A

SMILES

NCC[C@H](O)C(=O)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H]3O)[C@H]1O

InChI

InChIKey=XEQLFNPSYWZPOW-SVRMBHBBSA-N
InChI=1S/C21H41N5O12/c22-2-1-8(28)19(34)26-7-3-6(24)17(37-20-11(25)15(32)13(30)9(4-23)35-20)18(12(7)29)38-21-16(33)14(31)10(5-27)36-21/h6-18,20-21,27-33H,1-5,22-25H2,(H,26,34)/t6-,7+,8-,9+,10+,11+,12-,13+,14-,15+,16+,17+,18+,20+,21-/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H41N5O12
Molecular Weight 555.5765
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 15 / 15
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 17:16:48 GMT 2023
Edited
by admin
on Fri Dec 15 17:16:48 GMT 2023
Record UNII
285798GUS5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BUTIROSIN A
MI  
Common Name English
D-STREPTAMINE, O-2,6-DIAMINO-2,6-DIDEOXY-.ALPHA.-D-GLUCOPYRANOSYL-(1->4)-O-(.BETA.-D-XYLOFURANOSYL-(1->5))-N1-((2S)-4-AMINO-2-HYDROXY-1-OXOBUTYL)-2-DEOXY-
Common Name English
BUTIROSIN A [MI]
Common Name English
BUTYROSIN A
Common Name English
AMBUTYROSIN A
Common Name English
Code System Code Type Description
CHEBI
65112
Created by admin on Fri Dec 15 17:16:48 GMT 2023 , Edited by admin on Fri Dec 15 17:16:48 GMT 2023
PRIMARY
PUBCHEM
12302171
Created by admin on Fri Dec 15 17:16:48 GMT 2023 , Edited by admin on Fri Dec 15 17:16:48 GMT 2023
PRIMARY
EPA CompTox
DTXSID801336430
Created by admin on Fri Dec 15 17:16:48 GMT 2023 , Edited by admin on Fri Dec 15 17:16:48 GMT 2023
PRIMARY
FDA UNII
285798GUS5
Created by admin on Fri Dec 15 17:16:48 GMT 2023 , Edited by admin on Fri Dec 15 17:16:48 GMT 2023
PRIMARY
MERCK INDEX
m2800
Created by admin on Fri Dec 15 17:16:48 GMT 2023 , Edited by admin on Fri Dec 15 17:16:48 GMT 2023
PRIMARY Merck Index
CAS
34291-02-6
Created by admin on Fri Dec 15 17:16:48 GMT 2023 , Edited by admin on Fri Dec 15 17:16:48 GMT 2023
PRIMARY
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