Secologanin dimethyl acetal

Datasheet MSDS
Catalog Number
ANC02827
Product Name
Secologanin dimethyl acetal
CAS Number
77988-07-9
IUPAC Name
methyl (2S,3R,4S)-4-(2,2-dimethoxyethyl)-3-ethenyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-5-carboxylate
Synonyms
Secologanoside-7-methylester,(-)-Secologanindimethylacetal
Molecular Formula
C19H30O11
Molecular Weight
434.44
Appearance
Powder
Purity
>96%
SMILES
COC(C[C@H]1[C@H]([C@@H](OC=C1C(=O)OC)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)C=C)OC
InChI
InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3/t9-,10+,12-,14-,15+,16-,18+,19+/m1/s1
InChI Key
HUVIXLWRQSMCLN-PXRCHJMLSA-N
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