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Details

Stereochemistry ABSOLUTE
Molecular Formula C23H23ClO2
Molecular Weight 366.881
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CP-394531

SMILES

[H][C@]12CCC3=C(C=CC(O)=C3)[C@]1(CC4=CC=CC=C4)CC[C@@](O)(C2)C#CCl

InChI

InChIKey=CNOAOQSZNOTZLQ-OIBXWCBGSA-N
InChI=1S/C23H23ClO2/c24-13-12-22(26)10-11-23(15-17-4-2-1-3-5-17)19(16-22)7-6-18-14-20(25)8-9-21(18)23/h1-5,8-9,14,19,25-26H,6-7,10-11,15-16H2/t19-,22+,23+/m1/s1

HIDE SMILES / InChI

Molecular Formula C23H23ClO2
Molecular Weight 366.881
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:23:48 GMT 2023
Edited
by admin
on Sat Dec 16 09:23:48 GMT 2023
Record UNII
227D9ED2SI
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CP-394531
Common Name English
2,7-PHENANTHRENEDIOL, 2-(CHLOROETHYNYL)-1,2,3,4,4A,9,10,10A-OCTAHYDRO-4A-(PHENYLMETHYL)-, (2R,4AS,10AR)-
Systematic Name English
2,7-PHENANTHRENEDIOL, 2-(2-CHLOROETHYNYL)-1,2,3,4,4A,9,10,10A-OCTAHYDRO-4A-(PHENYLMETHYL)-, (2R,4AS,10AR)-
Systematic Name English
Code System Code Type Description
FDA UNII
227D9ED2SI
Created by admin on Sat Dec 16 09:23:48 GMT 2023 , Edited by admin on Sat Dec 16 09:23:48 GMT 2023
PRIMARY
CAS
305822-63-3
Created by admin on Sat Dec 16 09:23:48 GMT 2023 , Edited by admin on Sat Dec 16 09:23:48 GMT 2023
PRIMARY
PUBCHEM
9820558
Created by admin on Sat Dec 16 09:23:48 GMT 2023 , Edited by admin on Sat Dec 16 09:23:48 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY