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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H26O9
Molecular Weight 422.4257
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 7-DEOXYNIVALENOL TRIACETATE

SMILES

CC(=O)OC[C@]12CC(=O)C(C)=C[C@H]1O[C@@H]3[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@]2(C)[C@]34CO4

InChI

InChIKey=DBXKOXMQDLHFME-SUZJGXHKSA-N
InChI=1S/C21H26O9/c1-10-6-15-20(7-14(10)25,8-26-11(2)22)19(5)17(29-13(4)24)16(28-12(3)23)18(30-15)21(19)9-27-21/h6,15-18H,7-9H2,1-5H3/t15-,16-,17-,18-,19-,20-,21+/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
7-DEOXYNIVALENOL TRIACETATE
Common Name English
SCIRPEN-8-ONE, 3.ALPHA.,4.BETA.,15-TRIHYDROXY-, TRIACETATE
Preferred Name English
TRICHOTHEC-9-EN-8-ONE, 3,4,15-TRIS(ACETYLOXY)-12,13-EPOXY-, (3.ALPHA.,4.BETA.)-
Systematic Name English
(3.ALPHA.,4.BETA.)-3,4,15-TRIS(ACETYLOXY)-12,13-EPOXYTRICHOTHEC-9-EN-8-ONE
Systematic Name English
Code System Code Type Description
CAS
1930-11-6
Created by admin on Wed Apr 02 10:55:46 GMT 2025 , Edited by admin on Wed Apr 02 10:55:46 GMT 2025
PRIMARY
FDA UNII
TXL3H97VGM
Created by admin on Wed Apr 02 10:55:46 GMT 2025 , Edited by admin on Wed Apr 02 10:55:46 GMT 2025
PRIMARY
PUBCHEM
14036633
Created by admin on Wed Apr 02 10:55:46 GMT 2025 , Edited by admin on Wed Apr 02 10:55:46 GMT 2025
PRIMARY