Annotation Hits
N
Screening or library annotations
Compound
Hemibrevetoxin B
NSID
NS00075607
SMILES
[H][C@@]12C[C@]3([H])O[C@]4([H])CC[C@](C)(O)[C@@H](CC\C=C/C=C)O[C@@]4([H])CC[C@@]3(C)O[C@@]1([H])[C@@H](O)C[C@@H](CC(=C)C=O)O2
InChI
InChI=1S/C28H42O7/c1-5-6-7-8-9-24-27(3,31)12-10-21-22(33-24)11-13-28(4)25(34-21)16-23-26(35-28)20(30)15-19(32-23)14-18(2)17-29/h5-7,17,19-26,30-31H,1-2,8-16H2,3-4H3
InChIKey
HINDCSLBLBWIIV-UHFFFAOYSA-N
CAS Number
122271-91-4
2D Structure
RDKit depiction
See compound in other scientific sites:
References
N
Literature / database references
Patents
N
Patent records mentioning this compound
Monoisotopic Mass
N
Placeholder value (update later)
Temporal stripes
Literature stripe
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Patent stripe
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3D Structure
Interactive 3D view based on an RDKit ETKDG conformer (auto-loaded).