Basic information
- CAS
78280-92-9- Standard SMILES
CC1=CC(=O)C2(OC3OC(C)C(O)C(O)C3O)C=COC(OC3OC(CO)C(O)C(O)C3O)C12- InChIKey
WDMQLCVSWBENIY-UHFFFAOYSA-N- Molecular formula
- C21H30O13
- Average molar mass
- 490.5 g/mol
- Monoisotopic mass
- 490.16864101
Overview
teucardoside has been reported in Teucrium hircanicum and Teucrium polium with data available.
Names & identifiers
- Preferred name
- Teucardoside
- IUPAC
- 7-methyl-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4a-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-1,7a-dihydrocyclopenta[c]pyran-5-one
Names & synonyms
TEUCARDOSIDEteucardosidDTXSID60319645RefChem:932872DTXCID2027076878280-92-97-methyl-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4a-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-1,7a-dihydrocyclopenta[c]pyran-5-oneNSC348950NSC-3489501-(Hexopyranosyloxy)-7-methyl-5-oxo-5,7a-dihydrocyclopenta[c]pyran-4a(1H)-yl 6-deoxyhexopyranoside
Database identifiers
- CAS
78280-92-9- PubChem CID
- 336014
- DTXSID
DTXSID60319645
Properties
Computed structural properties
- XLogP
- -3.4
- Topological polar surface area
- 205 Ų
- Hydrogen bond donors
- 7
- Hydrogen bond acceptors
- 13
- Rotatable bonds
- 5
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 831
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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