Basic information
- CAS
140669-89-2- Standard SMILES
C=CC[C@]12C=C(OC)C(=O)[C@H](C1=O)[C@H](c1ccc(OC)c(OC)c1)[C@H]2C- InChIKey
IYEJIWMVJJRSMG-RQJAOHDJSA-N- Molecular formula
- C21H24O5
- Average molar mass
- 356.4 g/mol
Overview
Kadsurenin D has been reported in Nectandra grandiflora with data available.
Names & identifiers
- Preferred name
- Kadsurenin D
- IUPAC
- (1S,5S,6R,7R)-7-(3,4-dimethoxyphenyl)-3-methoxy-6-methyl-5-prop-2-enylbicyclo[3.2.1]oct-3-ene-2,8-dione
- English name
- Kadsurenin D
- Molecular formula
- C21H24O5
- Molecular weight
- 356.41
Names & synonyms
Kadsurenin D140669-89-2Bicyclo[3.2.1]oct-3-ene-2,8-dione, 7-(3,4-dimethoxyphenyl)-3-methoxy-6-methyl-5-(2-propen-1-yl)-, (1S,5S,6R,7R)-(1S,5S,6R,7R)-7-(3,4-dimethoxyphenyl)-3-methoxy-6-methyl-5-prop-2-enylbicyclo[3.2.1]oct-3-ene-2,8-dioneorb1682277MFCD28009413TN4365AKOS032949029CS-0024233H62912(1S,5S,6R,7R)-5-allyl-7-(3,4-dimethoxyphenyl)-3-methoxy-6-methyl-bicyclo[3.2.1]oct-3-ene-2,8-dione
Database identifiers
- CAS
140669-89-2
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 61.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 624
Physicochemical properties
- Boiling point
- 501.4 · 501.4±50.0 °C(Predicted)
- Density
- 1.18 · 1.18±0.1 g/cm3(Predicted)
- pka
- 7.88 · 7.88±0.70(Predicted)
Chemistry & industry
Applications
UsesKadsurenin D is a Lignans product that can be isolated from the aerial parts of Piper kadsura (Choisy) Ohwi.[1].
Suppliers22 total
武汉众志诚生物技术有限公司13628624121 13628604890 · [email protected]
云南西力生物技术股份有限公司0871-65217109 · [email protected]
Labnetwork lnc.+86-27-50766799 +86-18062016861 · [email protected]
四川省维克奇生物科技有限公司028-81700200 18116577057 · [email protected]
雷丁试剂0510-85629785 18013409632 · [email protected]
上海永叶生物科技有限公司86-021-61559134 15921386130 · [email protected]
EMMX Biotechnology LLC888-539-0666 · [email protected]
上海源叶生物科技有限公司13636370518 · [email protected]
上海澄绍生物科技有限公司021-61847300 13341622919 · [email protected]
南京尚书生物科技有限公司18266960953 · [email protected]
爱必信（上海）生物科技有限公司13761418683 · [email protected]
Shanghai Acmec Biochemical Technology Co., Ltd.+86-18621343501 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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