6β-oxymorphol (Q27264153)

6b-Oxymorphol (English)

14 October 2016

1 reference

C₁₇H₂₁NO₄

1 reference

6b-Oxymorphol (English)

14 October 2016

canonical SMILES

CN1CCC23C4C(CCC2(C1CC5=C3C(=C(C=C5)O)O4)O)O

1 reference

6b-Oxymorphol (English)

14 October 2016

isomeric SMILES

CN1CC[C@]23[C@@H]4[C@@H](CC[C@]2([C@H]1CC5=C3C(=C(C=C5)O)O4)O)O

1 reference

6b-Oxymorphol (English)

InChI=1S/C17H21NO4/c1-18-7-6-16-13-9-2-3-10(19)14(13)22-15(16)11(20)4-5-17(16,21)12(18)8-9/h2-3,11-12,15,19-21H,4-8H2,1H3/t11-,12-,15+,16+,17-/m1/s1

14 October 2016

Identifiers

InChI

1 reference

6b-Oxymorphol (English)

14 October 2016

1 reference

Global Substance Registration System

6b-Oxymorphol (English)

14 October 2016

2 references

UNII

67P6D5Q6YK

6β-oxymorphol (English)

14 October 2016

https://commonchemistry.cas.org/detail?cas_rn=54934-75-7

9 April 2021

1 reference

(5alpha,6beta)-17-Methyl-4,5-epoxymorphinan-3,6,14-triol (English)

14 October 2016

2 references

6b-Oxymorphol (English)

14 October 2016

ChEBI ID

174903

mapping relation type

exact match

2 references

stated in

ChEBI release 2022-06-13

International Chemical Identifier

InChI

InChI=1S/C17H21NO4/c1-18-7-6-16-13-9-2-3-10(19)14(13)22-15(16)11(20)4-5-17(16,21)12(18)8-9/h2-3,11-12,15,19-21H,4-8H2,1H3/t11-,12-,15+,16+,17-/m1/s1

1 reference

1 reference

Human Metabolome Database ID

HMDB0061076

2 references

based on heuristic

inferred from InChIKey

Global Substance Registration System

UNII

67P6D5Q6YK

2 references

stated in

UNII

67P6D5Q6YK

6β-oxymorphol (English)

14 October 2016