Chemical Compound

Brevetoxin B

CAS Registry Number 79580-28-2
Brevetoxin B chemical structure
Primary Record

Brevetoxin B

In stock
6,473 g
Purity
98.2 %
CAS
79580-28-2

Compound Identifiers & Properties

CAS
79580-28-2
PubChem CID
172993806
SMILES
C[C@H]1C[C@H]2[C@@H](C[C@]3([C@H](O2)C[C@H]4[C@H](O3)C(=CC(=O)O4)C)C)O[C@@H]5[C@@H]1O[C@H]6C[C@@H]7[C@](C[C@@H]8[C@@](O7)(C/C=C\[C@@H]9[C@@H](O8)C[C@@H]1[C@@H](O9)C[C@@H]2[C@@](O1)([C@H](C[C@H](O2)CC(=C)C=O)O)C)C)(O[C@@]6(CC5)C)C
Canonical SMILES
C=C(C=O)C[C@@H]1C[C@H](O)[C@]2(C)O[C@@H]3C[C@@H]4O[C@@H]5C[C@]6(C)O[C@]7(C)CC[C@@H]8O[C@@H]9C[C@]%10(C)O[C@@H]%11C(C)=CC(=O)O[C@H]%11C[C@H]%10O[C@H]9C[C@H](C)[C@H]8O[C@H]7C[C@H]6O[C@@]5(C)C/C=C\[C@H]4O[C@H]3C[C@H]2O1

Names & Synonyms

  • Brevetoxin B
  • brevetoxin-2
  • Brevetoxin 2
  • PbTx-2
  • BREVETOXIN PBTX-2-20C
  • MSK9116
  • BBF-00589
  • CID10865865
  • 79580-28-2