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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H30O5
Molecular Weight 362.4599
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(1-PROPYL)ZEARALANONE

SMILES

CCCC1=C(O)C2=C(CCCCCC(=O)CCC[C@H](C)OC2=O)C=C1O

InChI

InChIKey=OMJCYDZXUDLCOA-AWEZNQCLSA-N
InChI=1S/C21H30O5/c1-3-8-17-18(23)13-15-10-5-4-6-11-16(22)12-7-9-14(2)26-21(25)19(15)20(17)24/h13-14,23-24H,3-12H2,1-2H3/t14-/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H30O5
Molecular Weight 362.4599
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 Sat Dec 16 12:07:53 GMT 2023
Edited
by admin
on Sat Dec 16 12:07:53 GMT 2023
Record UNII
280E1L4JZW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-(1-PROPYL)ZEARALANONE
Common Name English
3-PROPYLZEARALANONE
Common Name English
1H-2-BENZOXACYCLOTETRADECIN-1,7(8H)-DIONE, 3,4,5,6,9,10,11,12-OCTAHYDRO-14,16-DIHYDROXY-3-METHYL-15-PROPYL-, (S)-
Systematic Name English
Code System Code Type Description
FDA UNII
280E1L4JZW
Created by admin on Sat Dec 16 12:07:53 GMT 2023 , Edited by admin on Sat Dec 16 12:07:53 GMT 2023
PRIMARY
CAS
76934-91-3
Created by admin on Sat Dec 16 12:07:53 GMT 2023 , Edited by admin on Sat Dec 16 12:07:53 GMT 2023
PRIMARY
PUBCHEM
133082398
Created by admin on Sat Dec 16 12:07:53 GMT 2023 , Edited by admin on Sat Dec 16 12:07:53 GMT 2023
PRIMARY