(Q27259170)

6,6-Difluoro-1-(3-hydroxyoctyl)-3-oxo-bicyclo(3.1.0)hexane-2-heptanoic acid, (1alpha(R*),2beta,5alpha)- (English)

14 October 2016

chemical formula

C₂₁H₃₄F₂O₄

1 reference

6,6-Difluoro-1-(3-hydroxyoctyl)-3-oxo-bicyclo(3.1.0)hexane-2-heptanoic acid, (1alpha(R*),2beta,5alpha)- (English)

14 October 2016

canonical SMILES

CCCCCC(CCC12C(C1(F)F)CC(=O)C2CCCCCCC(=O)O)O

1 reference

6,6-Difluoro-1-(3-hydroxyoctyl)-3-oxo-bicyclo(3.1.0)hexane-2-heptanoic acid, (1alpha(R*),2beta,5alpha)- (English)

14 October 2016

isomeric SMILES

CCCCC[C@H](CC[C@@]12[C@@H](C1(F)F)CC(=O)[C@H]2CCCCCCC(=O)O)O

1 reference

6,6-Difluoro-1-(3-hydroxyoctyl)-3-oxo-bicyclo(3.1.0)hexane-2-heptanoic acid, (1alpha(R*),2beta,5alpha)- (English)

InChI=1S/C21H34F2O4/c1-2-3-6-9-15(24)12-13-20-16(10-7-4-5-8-11-19(26)27)17(25)14-18(20)21(20,22)23/h15-16,18,24H,2-14H2,1H3,(H,26,27)/t15-,16-,18+,20-/m1/s1

14 October 2016

Identifiers

InChI

1 reference

6,6-Difluoro-1-(3-hydroxyoctyl)-3-oxo-bicyclo(3.1.0)hexane-2-heptanoic acid, (1alpha(R*),2beta,5alpha)- (English)

LHWNQUMYHFPBBM-ZTRFORPCSA-N

14 October 2016

InChIKey

1 reference

Global Substance Registration System

6,6-Difluoro-1-(3-hydroxyoctyl)-3-oxo-bicyclo(3.1.0)hexane-2-heptanoic acid, (1alpha(R*),2beta,5alpha)- (English)

14 October 2016

1 reference

UNII

48RTP2403U

(1α(R*),2β,5α)-6,6-difluoro-1-(3-hydroxyoctyl)-3-oxo-bicyclo(3.1.0)hexane-2-heptanoic acid (English)

14 October 2016

1 reference

7-{(1R,2S,5S)-6,6-Difluoro-1-[(3R)-3-hydroxyoctyl]-3-oxobicyclo[3.1.0]hex-2-yl}heptanoic acid (English)

14 October 2016

2 references

6,6-Difluoro-1-(3-hydroxyoctyl)-3-oxo-bicyclo(3.1.0)hexane-2-heptanoic acid, (1alpha(R*),2beta,5alpha)- (English)

matched by identifier from

14 October 2016

InChIKey

LHWNQUMYHFPBBM-ZTRFORPCSA-N

1 reference

2 references

Global Substance Registration System

UNII

48RTP2403U