Heliosin
Basic information
- CAS
72746-38-4- Standard SMILES
O=c1c(OCC(O)/C(O)=C(\O)C(O)COCC(O)/C(O)=C(\O)C(O)CO)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12- InChIKey
QIAVRJHHAWLZNB-RLPYSRNMSA-N- Molecular formula
- C27H30O17
- Average molar mass
- 626.5 g/mol
- Monoisotopic mass
- 626.14829948
Overview
isolated from Ze-Oi (Euphorbia helioscopia L)
Names & identifiers
- Preferred name
- Heliosin
- IUPAC
- 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(E)-2,3,4,5-tetrahydroxy-6-[(E)-2,3,4,5,6-pentahydroxyhex-3-enoxy]hex-3-enoxy]chromen-4-one
Names & synonyms
HeliosinQuercetin 3-digalactoside72746-38-4RefChem:1455052-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(E)-2,3,4,5-tetrahydroxy-6-[(E)-2,3,4,5,6-pentahydroxyhex-3-enoxy]hex-3-enoxy]chromen-4-oneSCHEMBL30083364
Database identifiers
- CAS
72746-38-4- PubChem CID
- 5491920
Properties
Computed structural properties
- XLogP
- -2.6
- Topological polar surface area
- 308 Ų
- Hydrogen bond donors
- 13
- Hydrogen bond acceptors
- 17
- Rotatable bonds
- 13
- Heavy atoms
- 44
- Formal charge
- 0
- Complexity
- 1,090
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…