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Details

Stereochemistry ABSOLUTE
Molecular Formula C15H22O4
Molecular Weight 266.3328
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ISOVERRUCAROL

SMILES

CC1=C[C@H]2O[C@@H]3[C@H](O)C[C@@](C)([C@]34CO4)[C@@]2(CO)CC1

InChI

InChIKey=NBRKAFIHDFEBCP-OJVARPOJSA-N
InChI=1S/C15H22O4/c1-9-3-4-14(7-16)11(5-9)19-12-10(17)6-13(14,2)15(12)8-18-15/h5,10-12,16-17H,3-4,6-8H2,1-2H3/t10-,11-,12-,13-,14-,15+/m1/s1

HIDE SMILES / InChI

Molecular Formula C15H22O4
Molecular Weight 266.3328
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 6 / 6
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 23:16:38 GMT 2025
Edited
by admin
on Mon Mar 31 23:16:38 GMT 2025
Record UNII
DOT2G8E75A
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3,15-DIDEACETYLCALONECTRIN
Preferred Name English
ISOVERRUCAROL
Common Name English
TRICHOTHEC-9-ENE-3,15-DIOL, 12,13-EPOXY-, (3.ALPHA.)-
Systematic Name English
3,15-DIDESACETYLCALONECTRIN
Common Name English
Code System Code Type Description
PUBCHEM
162331
Created by admin on Mon Mar 31 23:16:38 GMT 2025 , Edited by admin on Mon Mar 31 23:16:38 GMT 2025
PRIMARY
EPA CompTox
DTXSID10959611
Created by admin on Mon Mar 31 23:16:38 GMT 2025 , Edited by admin on Mon Mar 31 23:16:38 GMT 2025
PRIMARY
CAS
38818-67-6
Created by admin on Mon Mar 31 23:16:38 GMT 2025 , Edited by admin on Mon Mar 31 23:16:38 GMT 2025
PRIMARY
FDA UNII
DOT2G8E75A
Created by admin on Mon Mar 31 23:16:38 GMT 2025 , Edited by admin on Mon Mar 31 23:16:38 GMT 2025
PRIMARY