(Q27156201)

3beta-hydroxy-7-oxo-5alpha-cholan-24-oic acid

4651-67-6 (English)

9 October 2016

2 references

inferred from InChIKey

3beta-hydroxy-7-oxo-5beta-cholan-24-oic acid

inferred from InChI

1 reference

(4R)-4-[(3R,5R,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-7-oxo-1,2,3,4,5,6,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid

inferred from InChI

1 reference

inferred from InChI

chemical formula

C₂₄H₃₈O₄

1 reference

4651-67-6 (English)

19 November 2016

CC(CCC(=O)O)C1CCC2C1(CCC3C2C(=O)CC4C3(CCC(C4)O)C)C

1 reference

4651-67-6 (English)

19 November 2016

C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C(=O)C[C@H]4[C@@]3(CC[C@H](C4)O)C)C

1 reference

cholagogues and choleretics

4651-67-6 (English)

19 November 2016

1 reference

Medical Subject Headings

MeSH descriptor ID

C023020

InChI=1S/C24H38O4/c1-14(4-7-21(27)28)17-5-6-18-22-19(9-11-24(17,18)3)23(2)10-8-16(25)12-15(23)13-20(22)26/h14-19,22,25H,4-13H2,1-3H3,(H,27,28)/t14-,15+,16-,17-,18+,19+,22+,23+,24-/m1/s1

15 March 2018

Identifiers

InChI

1 reference

4651-67-6 (English)

19 November 2016

2 references

4651-67-6 (English)

19 November 2016

ChEBI release 2020-09-01

CAS Registry Number

4651-67-6

2 references

Global Substance Registration System

UNII

Y1357H1A28

nutriacholic acid (English)

19 November 2016

https://commonchemistry.cas.org/detail?cas_rn=4651-67-6

10 April 2021

1 reference

7-Oxolithocholic acid (English)

19 November 2016

2 references

4651-67-6 (English)

19 November 2016

Reaxys registry number

3222783

1 reference

7-oxolithocholic acid (English)

9 October 2016

ChEBI ID

82679

mapping relation type

2 references

CHEMBL1254169 (English)

19 November 2016

International Chemical Identifier

InChI

InChI=1S/C24H38O4/c1-14(4-7-21(27)28)17-5-6-18-22-19(9-11-24(17,18)3)23(2)10-8-16(25)12-15(23)13-20(22)26/h14-19,22,25H,4-13H2,1-3H3,(H,27,28)/t14-,15+,16-,17-,18+,19+,22+,23+,24-/m1/s1

1 reference

CHEMBL1254169 (English)

19 November 2016

2 references

inferred from InChIKey

MSBNK-BGC_Munich-RP008002

1 reference

MassBank accession ID

0 references

MSBNK-BGC_Munich-RP008003

0 references

MSBNK-BGC_Munich-RP008001

0 references

0 references

1 reference

NSC number

226118

0 references

EC number

225-083-2

1 reference

Global Substance Registration System

UNII

Y1357H1A28

nutriacholic acid (English)

ECHA Substance Infocard ID

19 November 2016

100.022.803

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.022.803

27 December 2018

3-α-hydroxy-7-oxo-5-β-cholan-24-oic acid (English)

quotation

CAS no.: 4651-67-6 (English)

MeSH descriptor ID

C023020

1 reference

Medical Subject Headings

MeSH descriptor ID

C023020

Human Metabolome Database ID

14 March 2018

0 references

2 references

Global Substance Registration System

UNII

Y1357H1A28

nutriacholic acid (English)

19 November 2016