eribulin (Q408717)

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pharmaceutical drug
  • 2-(3-Amino-2-hydroxypropyl)hexacosahydro-3-methoxy- 26-methyl-20,27-bis(methylene)11,15-18,21-24,28-triepoxy- 7,9-ethano-12,15-methano-9H,15H-furo(3,2-i)furo(2',3'-5,6) pyrano(4,3-b)(1,4)dioxacyclopentacosin-5-(4H)-one
  • eribulin mesylate
  • L01XX41
  • ER-086526
  • E7389
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Language Label Description Also known as
English
eribulin
pharmaceutical drug
  • 2-(3-Amino-2-hydroxypropyl)hexacosahydro-3-methoxy- 26-methyl-20,27-bis(methylene)11,15-18,21-24,28-triepoxy- 7,9-ethano-12,15-methano-9H,15H-furo(3,2-i)furo(2',3'-5,6) pyrano(4,3-b)(1,4)dioxacyclopentacosin-5-(4H)-one
  • eribulin mesylate
  • L01XX41
  • ER-086526
  • E7389

Statements

mass
729.409 dalton
1 reference
stated in
PubChem
PubChem CID
11354606
language of work or name
English
title
Eribulin (English)
retrieved
19 October 2016
chemical formula
C₄₀H₅₉NO₁₁
1 reference
stated in
PubChem
PubChem CID
11354606
language of work or name
English
title
Eribulin (English)
retrieved
20 November 2016
canonical SMILES
CC1CC2CCC3C(=C)CC(O3)CCC45CC6C(O4)C7C(O6)C(O5)C8C(O7)CCC(O8)CC(=O)CC9C(CC(C1=C)O2)OC(C9OC)CC(CN)O
1 reference
stated in
PubChem
PubChem CID
11354606
language of work or name
English
title
Eribulin (English)
retrieved
20 November 2016
isomeric SMILES
C[C@@H]1C[C@@H]2CC[C@H]3C(=C)C[C@@H](O3)CC[C@]45C[C@@H]6[C@H](O4)[C@H]7[C@@H](O6)[C@@H](O5)[C@@H]8[C@@H](O7)CC[C@@H](O8)CC(=O)C[C@H]9[C@H](C[C@H](C1=C)O2)O[C@@H]([C@@H]9OC)C[C@@H](CN)O
1 reference
stated in
PubChem
PubChem CID
11354606
language of work or name
English
title
Eribulin (English)
retrieved
20 November 2016

Identifiers

Reaxys registry number
9893060
1 reference
stated in
ChEBI
ChEBI ID
63587
language of work or name
English
title
eribulin (English)
retrieved
19 October 2016
LiverTox ID
Eribulin
0 references
EC number
803-583-7
1 reference
stated in
ECHA Substance Infocard database
ECHA Substance Infocard ID
100.230.372
retrieved
27 December 2018
title
[No public or meaningful name is available] (English)
quotation
CAS no.: 253128-41-5 (English)
ECHA Substance Infocard ID
100.230.372
1 reference
stated in
ECHA Substance Infocard database
ECHA Substance Infocard ID
100.230.372
retrieved
27 December 2018
title
[No public or meaningful name is available] (English)
quotation
CAS no.: 253128-41-5 (English)
PDB ligand ID
6K9
0 references
 
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