Cinobufagin

Datasheet MSDS
Catalog Number
ANC05899
Product Name
Cinobufagin
Structure
Cinobufagin
CAS Number
470-37-1
IUPAC Name
[(1R,2S,4R,5R,6R,7R,10S,11S,14S,16R)-14-hydroxy-7,11-dimethyl-6-(6-oxopyran-3-yl)-3-oxapentacyclo[8.8.0.02,4.02,7.011,16]octadecan-5-yl] acetate
Synonyms
cinobufaginvenomtoad
Molecular Formula
C26H34O6
Molecular Weight
442.55
Appearance
Powder
Purity
>98%
Solubility
Soluble in DMSO
Melting Point
205-209°C
Storage
Store at -20°C
SMILES
CC(=O)O[C@@H]1[C@@H]([C@]2(CC[C@H]3[C@H]([C@@]24[C@@H]1O4)CC[C@H]5[C@@]3(CC[C@@H](C5)O)C)C)C6=COC(=O)C=C6
InChI
InChI=1S/C26H34O6/c1-14(27)31-22-21(15-4-7-20(29)30-13-15)25(3)11-9-18-19(26(25)23(22)32-26)6-5-16-12-17(28)8-10-24(16,18)2/h4,7,13,16-19,21-23,28H,5-6,8-12H2,1-3H3/t16-,17+,18+,19-,21+,22-,23-,24+,25-,26-/m1/s1
InChI Key
SCULJPGYOQQXTK-OLRINKBESA-N
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