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

Details

Stereochemistry ABSOLUTE
Molecular Formula C16H18O5
Molecular Weight 290.3111
Optical Activity ( - )
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Dehydrocurvularin

SMILES

C[C@H]1CCC\C=C\C(=O)C2=C(O)C=C(O)C=C2CC(=O)O1

InChI

InChIKey=AVIRMQMUBGNCKS-RWCYGVJQSA-N
InChI=1S/C16H18O5/c1-10-5-3-2-4-6-13(18)16-11(8-15(20)21-10)7-12(17)9-14(16)19/h4,6-7,9-10,17,19H,2-3,5,8H2,1H3/b6-4+/t10-/m0/s1

HIDE SMILES / InChI

Molecular Formula C16H18O5
Molecular Weight 290.3111
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 18:50:03 GMT 2023
Edited
by admin
on Fri Dec 15 18:50:03 GMT 2023
Record UNII
PAU7YA7FF9
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Dehydrocurvularin
Common Name English
(15S)-(-)-Dehydrocurvularin
Common Name English
trans-Dehydrocurvularin
Common Name English
α,β-Dehydrocurvularin
Common Name English
(10E,15S)-10(11)-Dehydrocurvularin
Common Name English
(4S,8E)-4,5,6,7-Tetrahydro-11,13-dihydroxy-4-methyl-2H-3-benzoxacyclododecin-2,10(1H)-dione
Systematic Name English
2H-3-Benzoxacyclododecin-2,10(1H)-dione, 4,5,6,7-tetrahydro-11,13-dihydroxy-4-methyl-, [S-(E)]-
Systematic Name English
2H-3-Benzoxacyclododecin-2,10(1H)-dione, 4,5,6,7-tetrahydro-11,13-dihydroxy-4-methyl-, (4S,8E)-
Systematic Name English
(S)-10,11-Dehydrocurvularin
Common Name English
Code System Code Type Description
WIKIPEDIA
Dehydrocurvularin
Created by admin on Fri Dec 15 18:50:03 GMT 2023 , Edited by admin on Fri Dec 15 18:50:03 GMT 2023
PRIMARY
CAS
21178-57-4
Created by admin on Fri Dec 15 18:50:03 GMT 2023 , Edited by admin on Fri Dec 15 18:50:03 GMT 2023
PRIMARY
EPA CompTox
DTXSID101017526
Created by admin on Fri Dec 15 18:50:03 GMT 2023 , Edited by admin on Fri Dec 15 18:50:03 GMT 2023
PRIMARY
PUBCHEM
6438143
Created by admin on Fri Dec 15 18:50:03 GMT 2023 , Edited by admin on Fri Dec 15 18:50:03 GMT 2023
PRIMARY
FDA UNII
PAU7YA7FF9
Created by admin on Fri Dec 15 18:50:03 GMT 2023 , Edited by admin on Fri Dec 15 18:50:03 GMT 2023
PRIMARY
Related Record Type Details
ENANTIOMER -> ENANTIOMER