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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H26O2
Molecular Weight 298.4192
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 8.BETA.-VE2

SMILES

[H][C@@]12CC[C@H](O)[C@@]1(C)CC[C@]3([H])C4=CC=C(O)C=C4CC[C@@]23C=C

InChI

InChIKey=NMCRWZRLOOYKTG-SWBPCFCJSA-N
InChI=1S/C20H26O2/c1-3-20-11-8-13-12-14(21)4-5-15(13)16(20)9-10-19(2)17(20)6-7-18(19)22/h3-5,12,16-18,21-22H,1,6-11H2,2H3/t16-,17-,18+,19+,20-/m1/s1

HIDE SMILES / InChI

Molecular Formula C20H26O2
Molecular Weight 298.4192
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 17:31:18 GMT 2023
Edited
by admin
on Sat Dec 16 17:31:18 GMT 2023
Record UNII
D5KU4JGS7Y
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
8.BETA.-VE2
Common Name English
(8S,9S,13S,14S,17S)-8-ethenyl-13-methyl-7,9,11,12,14,15,16,17-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol
Systematic Name English
8.BETA.-VINYLESTRA-1,3,5(10)-TRIENE-3,17.BETA.-OL
Systematic Name English
Estra-1,3,5(10)-triene-3,17-diol, 8-ethenyl-, (17β)-
Systematic Name English
(17.BETA.)-8-ETHENYLESTRA-1,3,5(10)-TRIENE-3,17-DIOL
Systematic Name English
Code System Code Type Description
CAS
367929-02-0
Created by admin on Sat Dec 16 17:31:18 GMT 2023 , Edited by admin on Sat Dec 16 17:31:18 GMT 2023
PRIMARY
EPA CompTox
DTXSID801047801
Created by admin on Sat Dec 16 17:31:18 GMT 2023 , Edited by admin on Sat Dec 16 17:31:18 GMT 2023
PRIMARY
FDA UNII
D5KU4JGS7Y
Created by admin on Sat Dec 16 17:31:18 GMT 2023 , Edited by admin on Sat Dec 16 17:31:18 GMT 2023
PRIMARY
PUBCHEM
9832100
Created by admin on Sat Dec 16 17:31:18 GMT 2023 , Edited by admin on Sat Dec 16 17:31:18 GMT 2023
PRIMARY
WIKIPEDIA
8β-VE2
Created by admin on Sat Dec 16 17:31:18 GMT 2023 , Edited by admin on Sat Dec 16 17:31:18 GMT 2023
PRIMARY
Related Record Type Details
TARGET -> AGONIST
TARGET -> AGONIST