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Details

Stereochemistry MIXED
Molecular Formula C15H26O2
Molecular Weight 238.3657
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6-(5-HYDROXY-1-HEPTYL)BICYCLO(3,3,0)OCTAN-3-ONE

SMILES

CCC(O)CCCCC1CC[C@@H]2CC(=O)C[C@H]12

InChI

InChIKey=TYICAJUTUPUJQP-HNQLUHSGSA-N
InChI=1S/C15H26O2/c1-2-13(16)6-4-3-5-11-7-8-12-9-14(17)10-15(11)12/h11-13,15-16H,2-10H2,1H3/t11?,12-,13?,15-/m1/s1

HIDE SMILES / InChI

Molecular Formula C15H26O2
Molecular Weight 238.3657
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 2 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:26:13 GMT 2023
Edited
by admin
on Fri Dec 15 15:26:13 GMT 2023
Record UNII
OJI2Q36P5K
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
6-(5-HYDROXY-1-HEPTYL)BICYCLO(3,3,0)OCTAN-3-ONE
Systematic Name English
2(1H)-PENTALENONE, HEXAHYDRO-4-(5-HYDROXYHEPTYL)-
Systematic Name English
Code System Code Type Description
FDA UNII
OJI2Q36P5K
Created by admin on Fri Dec 15 15:26:13 GMT 2023 , Edited by admin on Fri Dec 15 15:26:13 GMT 2023
PRIMARY
CAS
89672-13-9
Created by admin on Fri Dec 15 15:26:13 GMT 2023 , Edited by admin on Fri Dec 15 15:26:13 GMT 2023
PRIMARY
PUBCHEM
135390838
Created by admin on Fri Dec 15 15:26:13 GMT 2023 , Edited by admin on Fri Dec 15 15:26:13 GMT 2023
PRIMARY