carbenoxolone (Q752861)

carbenoxolone (English)

(2S,4aS,6aR,6aS,6bR,8aR,10S,12aS,14bS)-10-(3-carboxy-1-oxopropoxy)-2,4a,6a,6b,9,9,12a-heptamethyl-13-oxo-3,4,5,6,6a,7,8,8a,10,11,12,14b-dodecahydro-1H-picene-2-carboxylic acid

19 October 2016

stereoisomer of

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₃₄H₅₀O₇

1 reference

carbenoxolone (English)

19 November 2016

canonical SMILES

CC1(C2CCC3(C(C2(CCC1OC(=O)CCC(=O)O)C)C(=O)C=C4C3(CCC5(C4CC(CC5)(C)C(=O)O)C)C)C)C

1 reference

carbenoxolone (English)

19 November 2016

isomeric SMILES

C[C@]12CC[C@](C[C@H]1C3=CC(=O)[C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)C)OC(=O)CCC(=O)O)C)(C)C(=O)O

1 reference

carbenoxolone (English)

physically interacts with

19 November 2016

Gap junction protein beta 7

1 reference

Gap junction protein beta 2

17 August 2016

1 reference

gap junction protein beta 6

17 August 2016

1 reference

Gap junction protein gamma 3

17 August 2016

1 reference

Gap junction protein beta 4

17 August 2016

1 reference

Gap junction protein beta 3

17 August 2016

1 reference

Gap junction protein beta 5

17 August 2016

1 reference

Gap junction protein delta 3

17 August 2016

1 reference

Gap junction protein beta 1

17 August 2016

1 reference

Gap junction protein delta 2

17 August 2016

1 reference

Gap junction protein alpha 4

17 August 2016

1 reference

Gap junction protein alpha 5

17 August 2016

1 reference

Gap junction protein delta 4

17 August 2016

1 reference

Gap junction protein alpha 1

17 August 2016

1 reference

Gap junction protein gamma 1

17 August 2016

1 reference

Gap junction protein alpha 3

17 August 2016

1 reference

Gap junction protein gamma 2

17 August 2016

1 reference

Gap junction protein alpha 8

17 August 2016

1 reference

Gap junction protein alpha 9

17 August 2016

1 reference

Gap junction protein alpha 10

17 August 2016

1 reference

17 August 2016

1 reference

17 August 2016

1 reference

17 August 2016

1 reference

InChI=1S/C34H50O7/c1-29(2)23-10-13-34(7)27(32(23,5)12-11-24(29)41-26(38)9-8-25(36)37)22(35)18-20-21-19-31(4,28(39)40)15-14-30(21,3)16-17-33(20,34)6/h18,21,23-24,27H,8-17,19H2,1-7H3,(H,36,37)(H,39,40)/t21-,23-,24-,27+,30+,31-,32-,33+,34+/m0/s1

17 August 2016

1 reference

Medical Subject Headings

15 March 2018

Carbenoxolone

0 references

Identifiers

InChI

1 reference

carbenoxolone (English)

OBZHEBDUNPOCJG-WBXJDKIVSA-N

19 November 2016

InChIKey

1 reference

carbenoxolone (English)

19 November 2016

2 references

carbenoxolone (English)

OBZHEBDUNPOCJG-WBXJDKIVSA-N

19 November 2016

InChIKey

8 April 2021

https://commonchemistry.cas.org/detail?cas_rn=5697-56-3

1 reference

Carbenoxolone (English)

19 November 2016

1 reference

carbenoxolone (English)

19 November 2016

1 reference

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

CARBENOXOLONE (English)

19 November 2016

1 reference

1 reference

DSSTOX compound identifier

DTXCID702733

0 references

EC number

227-174-2

1 reference

carbenoxolone (English)

ECHA Substance Infocard ID

19 November 2016

100.024.704

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.024.704

27 December 2018

AICS Chemical ID (BEING DELETED)

Carbenoxolone (English)

quotation

CAS no.: 5697-56-3 (English)

6768

0 references

ATC code

A02BX01

0 references

1 reference

D02.455.849.919.530.444.250

carbenoxolone (English)

19 November 2016

Carbenoxolone

0 references

MeSH tree code

0 references

RxNorm ID

2017

1 reference

carbenoxolone (English)

19 November 2016

1 reference

Carbenoxolone (English)

19 November 2016

1 reference

https://docs.openalex.org/download-snapshot/snapshot-data-format

carbenoxolone (English)

19 November 2016

0 references

1 reference

0 references

0 references

1 reference

28 October 2013

Microsoft Academic ID

0 references

1 reference

26 January 2022

1 reference

2BEL (English)

19 October 2016

1 reference

1HDC (English)