proscillaridin (Q7250550)

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chemical compound

Proscillaridin A
Bufa-4,20,22-trienolide, 3-[(6-deoxy-α-L-mannopyranosyl)oxy]-14-hydroxy-, (3β)-
(3β)-3-[(6-Deoxy-α-L-mannopyranosyl)oxy]-14-hydroxybufa-4,20,22-trienolide

Language	Label	Description	Also known as
English	proscillaridin	chemical compound	Proscillaridin A Bufa-4,20,22-trienolide, 3-[(6-deoxy-α-L-mannopyranosyl)oxy]-14-hydroxy-, (3β)- (3β)-3-[(6-Deoxy-α-L-mannopyranosyl)oxy]-14-hydroxybufa-4,20,22-trienolide

Statements

type of chemical entity

0 references

5-[(3S,8R,9S,10R,13R,14S,17R)-14-hydroxy-10,13-dimethyl-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-1,2,3,6,7,8,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]pyran-2-one

1 reference

based on heuristic

inferred from SMILES

chemical structure

Proscillaridin.png
1,485 × 1,052; 23 KB

0 references

530.288 dalton

1 reference

language of work or name

proscillaridin (English)

14 October 2016

stereoisomer of

5-((3S,8R,9S,10R,13R,14S,17R)-14-hydroxy-10,13-dimethyl-3-((2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yloxy)-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)-2H-pyran-2-one

1 reference

based on heuristic

inferred from InChI

5-[(3S,8S,9S,10R,13R,14S,17R)-14-hydroxy-10,13-dimethyl-3-[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-1,2,3,6,7,8,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]pyran-2-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₀H₄₂O₈

1 reference

language of work or name

proscillaridin (English)

19 November 2016

canonical SMILES

CC1C(C(C(C(O1)OC2CCC3(C4CCC5(C(CCC5(C4CCC3=C2)O)C6=COC(=O)C=C6)C)C)O)O)O

1 reference

language of work or name

proscillaridin (English)

19 November 2016

isomeric SMILES

C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@H]2CC[C@@]3([C@H]4CC[C@@]5([C@H](CC[C@@]5([C@@H]4CCC3=C2)O)C6=COC(=O)C=C6)C)C)O)O)O

1 reference

language of work or name

proscillaridin (English)

19 November 2016

defined daily dose

0.75 milligram

route of administration

oral administration

1 reference

https://www.whocc.no/atc_ddd_index/?code=C01AB01

1 reference

Quantitation of Principal Bufadienolides in Different Cytotypes of Urginea indica

Urginea maritima

6 references

Bufadienolides from Urginea maritima from Egypt

Bufadienolides and a new lignan from the bulbs of Urginea maritima

Die herzaktiven Substanzen der Meerzwiebel. Scillaren A

Die Doppelbindungen des Scillaridins A. (7. Mitteilung über Herzglucoside)

Bufadienolide ausUrginea pancration1

New bufadienolides from Urginea maritima sensu strictu

Drimia maritima

6 references

Bufadienolides and a new lignan from the bulbs of Urginea maritima

Bufadienolides from Urginea maritima from Egypt

Die herzaktiven Substanzen der Meerzwiebel. Scillaren A

Die Doppelbindungen des Scillaridins A. (7. Mitteilung über Herzglucoside)

Bufadienolide ausUrginea pancration1

New bufadienolides from Urginea maritima sensu strictu

subject has role

enzyme inhibitor

1 reference

Medical Subject Headings

MeSH descriptor ID

15 March 2018

1 reference

Medical Subject Headings

MeSH descriptor ID

15 March 2018

Identifiers

InChI=1S/C30H42O8/c1-16-24(32)25(33)26(34)27(37-16)38-19-8-11-28(2)18(14-19)5-6-22-21(28)9-12-29(3)20(10-13-30(22,29)35)17-4-7-23(31)36-15-17/h4,7,14-16,19-22,24-27,32-35H,5-6,8-13H2,1-3H3/t16-,19-,20+,21-,22+,24-,25+,26+,27-,28-,29+,30-/m0/s1

1 reference

language of work or name

proscillaridin (English)

19 November 2016

MYEJFUXQJGHEQK-ALRJYLEOSA-N

2 references

language of work or name

proscillaridin (English)

19 November 2016

ChEBI release 2020-09-01

CAS Registry Number

2 references

Global Substance Registration System

language of work or name

proscillaridin (English)

19 November 2016

MYEJFUXQJGHEQK-ALRJYLEOSA-N

CAS Common Chemistry

10 April 2021

https://commonchemistry.cas.org/detail?cas_rn=466-06-8

1 reference

language of work or name

Proscillaridin (English)

19 November 2016

2 references

language of work or name

proscillaridin (English)

19 November 2016

matched by identifier from

MYEJFUXQJGHEQK-ALRJYLEOSA-N

mapping relation type

2 references

ChEBI release 2019-10-02

matched by identifier from

International Chemical Identifier

InChI=1S/C30H42O8/c1-16-24(32)25(33)26(34)27(37-16)38-19-8-11-28(2)18(14-19)5-6-22-21(28)9-12-29(3)20(10-13-30(22,29)35)17-4-7-23(31)36-15-17/h4,7,14-16,19-22,24-27,32-35H,5-6,8-13H2,1-3H3/t16-,19-,20+,21-,22+,24-,25+,26+,27-,28-,29+,30-/m0/s1

1 reference

language of work or name

PROSCILLARIDIN (English)

19 November 2016

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

MYEJFUXQJGHEQK-ALRJYLEOSA-N

UniChem compound ID

1 reference

MassBank accession ID

MSBNK-Waters-WA002522

0 references

MSBNK-Waters-WA002523

0 references

MSBNK-Waters-WA002524

0 references

MSBNK-Waters-WA002525

0 references

DSSTox substance ID

2 references

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

matched by identifier from

MYEJFUXQJGHEQK-ALRJYLEOSA-N

DSSTOX compound identifier

0 references

0 references

0 references

1 reference

Global Substance Registration System

language of work or name

proscillaridin (English)

19 November 2016

ECHA Substance Infocard ID

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

27 December 2018

Proscillaridin (English)

CAS no.: 466-06-8 (English)

0 references

MeSH descriptor ID

subject named as

Proscillaridin

0 references

D04.210.500.155.580.064.580

0 references

D09.408.180.660

0 references

1 reference

Global Substance Registration System

language of work or name

proscillaridin (English)

19 November 2016

1 reference

matched by identifier from

MYEJFUXQJGHEQK-ALRJYLEOSA-N

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

MYEJFUXQJGHEQK-ALRJYLEOSA-N

2 references

Global Substance Registration System

language of work or name

proscillaridin (English)

19 November 2016

matched by identifier from

MYEJFUXQJGHEQK-ALRJYLEOSA-N

Probes And Drugs ID

0 references

1 reference

1 reference

http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download

15 January 2022

MYEJFUXQJGHEQK-ALRJYLEOSA-N

IEDB Epitope ID

1 reference

Immune Epitope Database and Analysis Resource

IEDB Epitope ID

1 March 2022

0 references

Microsoft Academic ID

0 references

Sitelinks

Wikipedia(6 entries)

Wikibooks(0 entries)

Wikinews(0 entries)

Wikiquote(0 entries)

Wikisource(0 entries)

Wikiversity(0 entries)

Wikivoyage(0 entries)

Wiktionary(0 entries)

Multilingual sites(0 entries)

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