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

Details

Stereochemistry ABSOLUTE
Molecular Formula C15H22O4
Molecular Weight 266.3328
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ODORATIN

SMILES

[H][C@]12C[C@@H](C)[C@]3([H])C[C@@H](O)[C@H](O)[C@@]3(C)C[C@]1([H])C(=C)C(=O)O2

InChI

InChIKey=ZFCRHGITKWEXDY-PYIPDKOLSA-N
InChI=1S/C15H22O4/c1-7-4-12-9(8(2)14(18)19-12)6-15(3)10(7)5-11(16)13(15)17/h7,9-13,16-17H,2,4-6H2,1,3H3/t7-,9-,10+,11-,12+,13+,15+/m1/s1

HIDE SMILES / InChI

Molecular Formula C15H22O4
Molecular Weight 266.3328
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 7 / 7
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

PubMed

PubMed

TitleDatePubMed
[Studies on chemical constituents from roots of Caragana sinica].
2008 Mar
Chemical constituents of the bark of Dipteryx alata vogel, an active species against Bothrops jararacussu venom.
2010 Nov 12
Patents

Patents

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:35:50 GMT 2023
Edited
by admin
on Sat Dec 16 18:35:50 GMT 2023
Record UNII
IAE4R6RO1N
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ODORATIN
Common Name English
GEIGERININ
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID20988775
Created by admin on Sat Dec 16 18:35:50 GMT 2023 , Edited by admin on Sat Dec 16 18:35:50 GMT 2023
PRIMARY
PUBCHEM
3080634
Created by admin on Sat Dec 16 18:35:50 GMT 2023 , Edited by admin on Sat Dec 16 18:35:50 GMT 2023
PRIMARY
FDA UNII
IAE4R6RO1N
Created by admin on Sat Dec 16 18:35:50 GMT 2023 , Edited by admin on Sat Dec 16 18:35:50 GMT 2023
PRIMARY
CAS
6902-72-3
Created by admin on Sat Dec 16 18:35:50 GMT 2023 , Edited by admin on Sat Dec 16 18:35:50 GMT 2023
PRIMARY