Basic information
- CAS
102349-35-9- Standard SMILES
COc1cc([C@H]2Oc3c(OC)cc4c(=O)c5ccccc5oc4c3O[C@@H]2CO)cc(OC)c1O- InChIKey
MIKIHCHUGBZLHD-DENIHFKCSA-N- Molecular formula
- C25H22O9
- Average molar mass
- 466.4 g/mol
- Monoisotopic mass
- 466.12638228
Overview
Cadensin D has been reported in Hypericum geminiflorum, Psorospermum febrifugum, and Hypericum canariense with data available.
Names & identifiers
- Preferred name
- Cadensin D
- IUPAC
- (2R,3R)-3-(4-hydroxy-3,5-dimethoxyphenyl)-2-(hydroxymethyl)-5-methoxy-2,3-dihydro-[1,4]dioxino[2,3-c]xanthen-7-one
- English name
- Cadensin D
- Molecular formula
- C25H22O9
- Molecular weight
- 466.44
Names & synonyms
Cadensin D102349-35-9(2R,3R)-3-(4-hydroxy-3,5-dimethoxyphenyl)-2-(hydroxymethyl)-5-methoxy-2,3-dihydro-[1,4]dioxino[2,3-c]xanthen-7-one7H-1,4-Dioxino[2,3-c]xanthen-7-one, 2,3-dihydro-3-(4-hydroxy-3,5-dimethoxyphenyl)-2-(hydroxymethyl)-5-methoxy-, (2R,3R)-rel-Hypericorin(2r,3r)-3-(4-hydroxy-3,5-dimethoxyphenyl)-2-(hydroxymethyl)-5-methoxy-2,3-dihydro-7h-[1,4]dioxino[2,3-c]xanthen-7-oneorb1683023DTXSID50907398C25H22O9TN3562AKOS0407614427H-1,4-Dioxino[2,3-c]xanthen-7-one,2,3-dihydro-3-(4-hydroxy-3,5-dimethoxyphenyl)-2-(hydroxymethyl)-5-methoxy-,(2R,3R)-rel-
Show more names
CS-0149531F92755(2R,3R)-3-(4-hydroxy-3,5-dimethoxy-phenyl)-2-(hydroxymethyl)-5-methoxy-2,3-dihydro-[1,4]dioxino[2,3-c]xanthen-7-one3-(4-Hydroxy-3,5-dimethoxyphenyl)-2-(hydroxymethyl)-5-methoxy-2,3-dihydro-7H-[1,4]dioxino[2,3-c]xanthen-7-one
Database identifiers
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 113 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 5
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 704
Physicochemical properties
- Melting point
- 241 · 241-243 °C
- Boiling point
- 705.9 · 705.9±60.0 °C(Predicted)
- Density
- 1.389 · 1.389±0.06 g/cm3(Predicted)
- pka
- 9.65 · 9.65±0.40(Predicted)
Chemistry & industry
Applications
UsesCadensin D is a Xanthones product that can be isolated from the stems and leaves of Hypericum japonicum.[1].
Suppliers11 total
武汉众志诚生物技术有限公司13628624121 13628604890 · [email protected]
上海弘顺生物科技有限公司15901914505 · [email protected]
成都普思生物科技股份有限公司028-85370565-229 18080489829 · [email protected]
云南西力生物技术股份有限公司0871-65217109 · [email protected]
四川省维克奇生物科技有限公司028-81700200 18116577057 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
上海博湖生物科技有限公司021-57763112 13585886131 · [email protected]
上海莫奇生物科技有限公司13341702378 · [email protected]
四川百奥克睿生物科技有限公司28-86-28-8543-3893 13260669172 · [email protected]
北京谱析科技有限公司400-808-7372 13161114455 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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