U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C10H18O
Molecular Weight 154.2493
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Neopinocampheol, (+)-

SMILES

C[C@@H]1[C@@H]2C[C@H](C[C@@H]1O)C2(C)C

InChI

InChIKey=REPVLJRCJUVQFA-HXFLIBJXSA-N
InChI=1S/C10H18O/c1-6-8-4-7(5-9(6)11)10(8,2)3/h6-9,11H,4-5H2,1-3H3/t6-,7-,8+,9+/m1/s1

HIDE SMILES / InChI

Molecular Formula C10H18O
Molecular Weight 154.2493
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:07:43 GMT 2023
Edited
by admin
on Sat Dec 16 19:07:43 GMT 2023
Record UNII
6L39MY43QK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Neopinocampheol, (+)-
Common Name English
Bicyclo[3.1.1]heptan-3-ol, 2,6,6-trimethyl-, [1S-(1α,2α,3α,5α)]-
Systematic Name English
Bicyclo[3.1.1]heptan-3-ol, 2,6,6-trimethyl-, (1S,2R,3S,5R)-
Systematic Name English
(1S,2R,3S,5R)-2,6,6-Trimethylbicyclo[3.1.1]heptan-3-ol
Systematic Name English
(+)-3α-Hydroxy-10α-pinane
Common Name English
(+)-Neopinocampheol
Common Name English
Code System Code Type Description
FDA UNII
6L39MY43QK
Created by admin on Sat Dec 16 19:07:43 GMT 2023 , Edited by admin on Sat Dec 16 19:07:43 GMT 2023
PRIMARY
PUBCHEM
11892930
Created by admin on Sat Dec 16 19:07:43 GMT 2023 , Edited by admin on Sat Dec 16 19:07:43 GMT 2023
PRIMARY
CAS
36129-11-0
Created by admin on Sat Dec 16 19:07:43 GMT 2023 , Edited by admin on Sat Dec 16 19:07:43 GMT 2023
PRIMARY
EPA CompTox
DTXSID601208045
Created by admin on Sat Dec 16 19:07:43 GMT 2023 , Edited by admin on Sat Dec 16 19:07:43 GMT 2023
PRIMARY