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Details

Stereochemistry RACEMIC
Molecular Formula C21H34O2
Molecular Weight 318.4935
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CP-47947

SMILES

CCCCCCC(C)(C)C1=CC=C([C@H]2CCC[C@@H](O)C2)C(O)=C1

InChI

InChIKey=ZWWRREXSUJTKNN-FUHWJXTLSA-N
InChI=1S/C21H34O2/c1-4-5-6-7-13-21(2,3)17-11-12-19(20(23)15-17)16-9-8-10-18(22)14-16/h11-12,15-16,18,22-23H,4-10,13-14H2,1-3H3/t16-,18+/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H34O2
Molecular Weight 318.4935
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 20:57:29 GMT 2025
Edited
by admin
on Tue Apr 01 20:57:29 GMT 2025
Record UNII
FAPQAUKC04
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CP-47947
Code English
(±)-CP-47497
Preferred Name English
CP-47,947
Code English
PHENOL, 5-(1,1-DIMETHYLHEPTYL)-2-(3-HYDROXYCYCLOHEXYL)-, CIS-
Systematic Name English
PHENOL, 5-(1,1-DIMETHYLHEPTYL)-2-((1R,3S)-3-HYDROXYCYCLOHEXYL)-, REL-
Systematic Name English
CP 47,497
Code English
REL-5-(1,1-DIMETHYLHEPTYL)-2-((1R,3S)-3-HYDROXYCYCLOHEXYL)PHENOL
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID401009968
Created by admin on Tue Apr 01 20:57:29 GMT 2025 , Edited by admin on Tue Apr 01 20:57:29 GMT 2025
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WIKIPEDIA
CP 47,497
Created by admin on Tue Apr 01 20:57:29 GMT 2025 , Edited by admin on Tue Apr 01 20:57:29 GMT 2025
PRIMARY
HSDB
8001
Created by admin on Tue Apr 01 20:57:29 GMT 2025 , Edited by admin on Tue Apr 01 20:57:29 GMT 2025
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FDA UNII
FAPQAUKC04
Created by admin on Tue Apr 01 20:57:29 GMT 2025 , Edited by admin on Tue Apr 01 20:57:29 GMT 2025
PRIMARY
CAS
70434-82-1
Created by admin on Tue Apr 01 20:57:29 GMT 2025 , Edited by admin on Tue Apr 01 20:57:29 GMT 2025
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