drotebanol (Q5308615)

Oxymethebanol (English)

18 November 2016

chemical formula

C₁₉H₂₇NO₄

1 reference

Oxymethebanol (English)

18 November 2016

canonical SMILES

CN1CCC23CC(CCC2(C1CC4=C3C(=C(C=C4)OC)OC)O)O

1 reference

Oxymethebanol (English)

18 November 2016

isomeric SMILES

CN1CC[C@]23C[C@@H](CC[C@]2([C@H]1CC4=C3C(=C(C=C4)OC)OC)O)O

1 reference

Oxymethebanol (English)

18 November 2016

0 references

1 reference

1 reference

Medical Subject Headings

MeSH descriptor ID

C001387

InChI=1S/C19H27NO4/c1-20-9-8-18-11-13(21)6-7-19(18,22)15(20)10-12-4-5-14(23-2)17(24-3)16(12)18/h4-5,13,15,21-22H,6-11H2,1-3H3/t13-,15-,18-,19-/m1/s1

15 March 2018

Identifiers

InChI

1 reference

Oxymethebanol (English)

18 November 2016

2 references

Oxymethebanol (English)

18 November 2016

ChEBI release 2020-09-01

CAS Registry Number

3176-03-2

2 references

Global Substance Registration System

UNII

7RS2Q8MCK8

drotebanol (English)

18 November 2016

https://commonchemistry.cas.org/detail?cas_rn=3176-03-2

10 April 2021

1 reference

Oxymetebanol (JAN) (English)

18 November 2016

2 references

Oxymethebanol (English)

18 November 2016

ChEBI ID

31951

mapping relation type

exact match

2 references

ChEBI release 2019-10-02

International Chemical Identifier

InChI

InChI=1S/C19H27NO4/c1-20-9-8-18-11-13(21)6-7-19(18,22)15(20)10-12-4-5-14(23-2)17(24-3)16(12)18/h4-5,13,15,21-22H,6-11H2,1-3H3/t13-,15-,18-,19-/m1/s1

SureChEMBL ID

SCHEMBL98993

2 references

based on heuristic

inferred from InChIKey

1 reference

1 reference

MeSH descriptor ID

C001387

1 reference

Medical Subject Headings

14 March 2018

1 reference

UNII

7RS2Q8MCK8

2 references

Global Substance Registration System

UNII

7RS2Q8MCK8

drotebanol (English)

18 November 2016

imported from Wikimedia project

0 references

1 reference

1 reference

English Wikipedia

Freebase ID

/m/04045hs

0 references

Microsoft Academic ID

0 references

1 reference

inferred by common MeSH mappings on source and on Wikidata

UMLS 2023