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Details

Stereochemistry MIXED
Molecular Formula C24H40O3
Molecular Weight 380.5888
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CP-55940 H-3

SMILES

[3H]C(CCCC)C([3H])C(C)(C)C1=CC(O)=C(C=C1)[C@@H]2C[C@H](O)CC[C@H]2CCCO

InChI

InChIKey=YNZFFALZMRAPHQ-BVJNDEIJSA-N
InChI=1S/C24H40O3/c1-4-5-6-7-14-24(2,3)19-11-13-21(23(27)16-19)22-17-20(26)12-10-18(22)9-8-15-25/h11,13,16,18,20,22,25-27H,4-10,12,14-15,17H2,1-3H3/t18-,20-,22-/m1/s1/i7T,14T/t7?,14?,18-,20-,22-

HIDE SMILES / InChI

Molecular Formula C24H40O3
Molecular Weight 380.5888
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 3 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 20:11:06 GMT 2023
Edited
by admin
on Sat Dec 16 20:11:06 GMT 2023
Record UNII
H5DU4FDS5M
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CP-55940 H-3
Common Name English
5-(1,1-Dimethylheptyl-2,3-t2)-2-[(1R,2R,5R)-5-hydroxy-2-(3-hydroxypropyl)cyclohexyl]phenol
Systematic Name English
Phenol, 5-(1,1-dimethylheptyl-2,3-t2)-2-[(1R,2R,5R)-5-hydroxy-2-(3-hydroxypropyl)cyclohexyl]-
Systematic Name English
CP55940 H-3
Common Name English
[3H]CP-55940
Common Name English
[3H]CP55940
Common Name English
Code System Code Type Description
CAS
1095586-82-5
Created by admin on Sat Dec 16 20:11:06 GMT 2023 , Edited by admin on Sat Dec 16 20:11:06 GMT 2023
PRIMARY
FDA UNII
H5DU4FDS5M
Created by admin on Sat Dec 16 20:11:06 GMT 2023 , Edited by admin on Sat Dec 16 20:11:06 GMT 2023
PRIMARY
Related Record Type Details
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