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

Details

Stereochemistry ACHIRAL
Molecular Formula C12H17NO7
Molecular Weight 287.2659
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of EPITETRAPHYLLIN B

SMILES

OC[C@H]1O[C@@H](O[C@@]2(C[C@@H](O)C=C2)C#N)[C@H](O)[C@@H](O)[C@@H]1O

InChI

InChIKey=JRCWYCAEAZEYNW-WTMYBKBASA-N
InChI=1S/C12H17NO7/c13-5-12(2-1-6(15)3-12)20-11-10(18)9(17)8(16)7(4-14)19-11/h1-2,6-11,14-18H,3-4H2/t6-,7+,8+,9-,10+,11-,12-/m0/s1

HIDE SMILES / InChI

Molecular Formula C12H17NO7
Molecular Weight 287.2659
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 7 / 7
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:40:31 GMT 2023
Edited
by admin
on Sat Dec 16 11:40:31 GMT 2023
Record UNII
268SUZ5208
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
EPITETRAPHYLLIN B
Common Name English
VOLKENIN
Common Name English
2-CYCLOPENTENE-1-CARBONITRILE, 1-(.BETA.-D-GLUCOPYRANOSYLOXY)-4-HYDROXY-, (1R,4R)-
Systematic Name English
Code System Code Type Description
FDA UNII
268SUZ5208
Created by admin on Sat Dec 16 11:40:31 GMT 2023 , Edited by admin on Sat Dec 16 11:40:31 GMT 2023
PRIMARY
CAS
66575-40-4
Created by admin on Sat Dec 16 11:40:31 GMT 2023 , Edited by admin on Sat Dec 16 11:40:31 GMT 2023
PRIMARY
EPA CompTox
DTXSID601147978
Created by admin on Sat Dec 16 11:40:31 GMT 2023 , Edited by admin on Sat Dec 16 11:40:31 GMT 2023
PRIMARY
PUBCHEM
181811
Created by admin on Sat Dec 16 11:40:31 GMT 2023 , Edited by admin on Sat Dec 16 11:40:31 GMT 2023
PRIMARY