Chemical Name | Agnuside |
---|---|
CAT No. | CS-O-06159 |
CAS Registry# | 11027-63-7 |
Status | Available for Immediate Dispatch |
Category | API Standards |
Mol. Wt. | 466.44 g/mol |
Mol. For. | C22H26O11 |
Hazardous | This is not a Hazardous Compound |
COA | View Sample COA |
MSDS | View Sample MSDS |
Controlled | No |
---|---|
Parent API | Agnuside |
Purity | 99.59 |
Smileys | C1=COC(C2C1C(C=C2COC(=O)C3=CC=C(C=C3)O)O)OC4C(C(C(C(O4)CO)O)O)O |
Canonical Smiles | C1=COC(C2C1C(C=C2COC(=O)C3=CC=C(C=C3)O)O)OC4C(C(C(C(O4)CO)O)O)O |
InchIKey | GLACGTLACKLUJX-QNAXTHAFSA-N |
Inchl | InChI=1S/C22H26O11/c23-8-15-17(26)18(27)19(28)22(32-15)33-21-16-11(7-14(25)13(16)5-6-30-21)9-31-20(29)10-1-3-12(24)4-2-10/h1-7,13-19,21-28H,8-9H2/t13-,14+,15+,16+,17+,18-,19+,21-,22-/m0/s1 |
IUPAC | [(1S,4aR,5S,7aS)-5-hydroxy-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-7-yl]methyl 4-hydroxybenzoate |
Hazardous | No |
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