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

Details

Stereochemistry ABSOLUTE
Molecular Formula C15H26O
Molecular Weight 222.3663
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIHYDROAGAROFURAN. CIS-

SMILES

C[C@@H]1CCC[C@]2(C)CC[C@@H]3C[C@]12OC3(C)C

InChI

InChIKey=HVAVUZLEYSAYGE-GBOPCIDUSA-N
InChI=1S/C15H26O/c1-11-6-5-8-14(4)9-7-12-10-15(11,14)16-13(12,2)3/h11-12H,5-10H2,1-4H3/t11-,12-,14-,15+/m1/s1

HIDE SMILES / InChI

Molecular Formula C15H26O
Molecular Weight 222.3663
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:08:00 GMT 2023
Edited
by admin
on Sat Dec 16 10:08:00 GMT 2023
Record UNII
7QLI5HGG0I
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DIHYDROAGAROFURAN. CIS-
Common Name English
CIS-DIHYDROAGAROFURAN
Common Name English
2H-3,9A-METHANO-1-BENZOXEPIN, OCTAHYDRO-2,2,5A,9-TETRAMETHYL-, (3R,5AR,9R,9AS)-
Systematic Name English
2H-3,9A-METHANO-1-BENZOXEPIN, OCTAHYDRO-2,2,5A,9-TETRAMETHYL-, (3R-(3.ALPHA.,5A.BETA.,9.ALPHA.,9A.ALPHA.))-
Common Name English
Code System Code Type Description
FDA UNII
7QLI5HGG0I
Created by admin on Sat Dec 16 10:08:00 GMT 2023 , Edited by admin on Sat Dec 16 10:08:00 GMT 2023
PRIMARY
CAS
150652-94-1
Created by admin on Sat Dec 16 10:08:00 GMT 2023 , Edited by admin on Sat Dec 16 10:08:00 GMT 2023
PRIMARY
PUBCHEM
90478975
Created by admin on Sat Dec 16 10:08:00 GMT 2023 , Edited by admin on Sat Dec 16 10:08:00 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> CONSTITUENT ALWAYS PRESENT
0.1%% of chemical composition of the leaf essential oil from Moringa oleifera.