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proscillaridin
(Q7250550)
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From Wikidata
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
edit
Language
Label
Description
Also known as
default for all languages
No label defined
–
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
instance of
type of chemical entity
0 references
subclass of
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
mass
530.288
dalton
1 reference
stated in
PubChem
PubChem CID
5284613
language of work or name
English
title
proscillaridin
(English)
retrieved
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
stated in
PubChem
PubChem CID
5284613
language of work or name
English
title
proscillaridin
(English)
retrieved
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
stated in
PubChem
PubChem CID
5284613
language of work or name
English
title
proscillaridin
(English)
retrieved
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
stated in
PubChem
PubChem CID
5284613
language of work or name
English
title
proscillaridin
(English)
retrieved
19 November 2016
defined daily dose
0.75
milligram
route of administration
oral administration
1 reference
reference URL
https://www.whocc.no/atc_ddd_index/?code=C01AB01
found in taxon
Drimia indica
1 reference
stated in
Quantitation of Principal Bufadienolides in Different Cytotypes of Urginea indica
Urginea maritima
6 references
stated in
Bufadienolides from Urginea maritima from Egypt
stated in
Bufadienolides and a new lignan from the bulbs of Urginea maritima
stated in
Die herzaktiven Substanzen der Meerzwiebel. Scillaren A
stated in
Die Doppelbindungen des Scillaridins A. (7. Mitteilung über Herzglucoside)
stated in
Bufadienolide ausUrginea pancration1
stated in
New bufadienolides from Urginea maritima sensu strictu
Drimia maritima
6 references
stated in
Bufadienolides and a new lignan from the bulbs of Urginea maritima
stated in
Bufadienolides from Urginea maritima from Egypt
stated in
Die herzaktiven Substanzen der Meerzwiebel. Scillaren A
stated in
Die Doppelbindungen des Scillaridins A. (7. Mitteilung über Herzglucoside)
stated in
Bufadienolide ausUrginea pancration1
stated in
New bufadienolides from Urginea maritima sensu strictu
subject has role
enzyme inhibitor
1 reference
stated in
Medical Subject Headings
MeSH descriptor ID
D011442
retrieved
15 March 2018
cardiotonic
1 reference
stated in
Medical Subject Headings
MeSH descriptor ID
D011442
retrieved
15 March 2018
Identifiers
InChI
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
stated in
PubChem
PubChem CID
5284613
language of work or name
English
title
proscillaridin
(English)
retrieved
19 November 2016
InChIKey
MYEJFUXQJGHEQK-ALRJYLEOSA-N
2 references
stated in
PubChem
PubChem CID
5284613
language of work or name
English
title
proscillaridin
(English)
retrieved
19 November 2016
stated in
ChEBI release 2020-09-01
CAS Registry Number
466-06-8
2 references
stated in
Global Substance Registration System
UNII
KC6BL281EN
language of work or name
English
title
proscillaridin
(English)
retrieved
19 November 2016
InChIKey
MYEJFUXQJGHEQK-ALRJYLEOSA-N
stated in
CAS Common Chemistry
retrieved
10 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=466-06-8
ChemSpider ID
4447658
1 reference
stated in
ChemSpider
ChemSpider ID
4447658
language of work or name
English
title
Proscillaridin
(English)
retrieved
19 November 2016
PubChem CID
5284613
2 references
stated in
PubChem
PubChem CID
5284613
language of work or name
English
title
proscillaridin
(English)
retrieved
19 November 2016
matched by identifier from
InChIKey
InChIKey
MYEJFUXQJGHEQK-ALRJYLEOSA-N
ChEBI ID
32065
mapping relation type
exact match
2 references
stated in
ChEBI release 2019-10-02
matched by identifier from
International Chemical Identifier
InChI
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
ChEMBL ID
CHEMBL600325
1 reference
stated in
ChEMBL
ChEMBL ID
CHEMBL600325
language of work or name
English
title
PROSCILLARIDIN
(English)
retrieved
19 November 2016
SureChEMBL ID
SCHEMBL123759
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
MYEJFUXQJGHEQK-ALRJYLEOSA-N
UniChem compound ID
548034
1 reference
stated in
UniChem
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
DTXSID5023532
2 references
stated in
Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard
matched by identifier from
InChIKey
InChIKey
MYEJFUXQJGHEQK-ALRJYLEOSA-N
DSSTOX compound identifier
DTXCID003532
0 references
NSC number
7521
0 references
759307
0 references
EC number
207-370-4
1 reference
stated in
Global Substance Registration System
UNII
KC6BL281EN
language of work or name
English
title
proscillaridin
(English)
retrieved
19 November 2016
ECHA Substance Infocard ID
100.006.702
1 reference
stated in
ECHA Substance Infocard database
ECHA Substance Infocard ID
100.006.702
retrieved
27 December 2018
title
Proscillaridin
(English)
quotation
CAS no.: 466-06-8
(English)
ATC code
C01AB01
0 references
MeSH descriptor ID
D011442
subject named as
Proscillaridin
0 references
MeSH tree code
D04.210.500.155.580.064.580
0 references
D09.408.180.660
0 references
RxNorm ID
8795
1 reference
stated in
Global Substance Registration System
UNII
KC6BL281EN
language of work or name
English
title
proscillaridin
(English)
retrieved
19 November 2016
DrugBank ID
DB13307
1 reference
matched by identifier from
InChIKey
InChIKey
MYEJFUXQJGHEQK-ALRJYLEOSA-N
KNApSAcK ID
C00056089
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
MYEJFUXQJGHEQK-ALRJYLEOSA-N
UNII
KC6BL281EN
2 references
stated in
Global Substance Registration System
UNII
KC6BL281EN
language of work or name
English
title
proscillaridin
(English)
retrieved
19 November 2016
matched by identifier from
InChIKey
InChIKey
MYEJFUXQJGHEQK-ALRJYLEOSA-N
Probes And Drugs ID
PD013285
0 references
DrugCentral ID
2313
1 reference
stated in
UniChem
LIPID MAPS ID
LMST01130008
1 reference
stated in
LIPID MAPS
reference URL
http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download
retrieved
15 January 2022
InChIKey
MYEJFUXQJGHEQK-ALRJYLEOSA-N
IEDB Epitope ID
952751
1 reference
stated in
Immune Epitope Database and Analysis Resource
IEDB Epitope ID
952751
retrieved
1 March 2022
Freebase ID
/m/0ggg3s
0 references
Microsoft Academic ID
2779760206
0 references
Sitelinks
Wikipedia
(6 entries)
edit
enwiki
Proscillaridin
eswiki
Proscilaridina
fiwiki
Proskillaridiini
shwiki
Proscilaridin
srwiki
Proscilaridin
viwiki
Proscillaridin
Wikibooks
(0 entries)
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(0 entries)
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Wikiquote
(0 entries)
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Wikisource
(0 entries)
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Wikiversity
(0 entries)
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Wikivoyage
(0 entries)
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Wiktionary
(0 entries)
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Multilingual sites
(0 entries)
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