Basic information
- CAS
6882-66-2- Standard SMILES
O=c1cccc2n1C[C@@H]1CCCN3CCC[C@H]2[C@H]13- InChIKey
MMCQRJPAMIHLQX-ZOWXZIJZSA-N- Molecular formula
- C15H20N2O
- Average molar mass
- 244.33 g/mol
- Monoisotopic mass
- 244.15756327
Overview
Sophoramine is a naphthyridine derivative.
Names & identifiers
- Preferred name
- (-)-Sophoramine
- IUPAC
- (1S,9S,17S)-7,13-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-2,4-dien-6-one
- English name
- Sophoramine
- Molecular formula
- C15H20N2O
- Molecular weight
- 244.33
Names & synonyms
Sophoramine6882-66-2(-)-Sophoramine(1S,9S,17S)-7,13-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-2,4-dien-6-oneDTXSID00218926(1S,9S,17S)-7,13-diazatetracyclo(7.7.1.02,7.013,17)heptadeca-2,4-dien-6-oneRefChem:905577DTXCID5014141711,12,13,14-Tetradehydromatridin-15-oneMFCD01632128C10782(+)-Sophoramine
Show more names
SOPHORAMINE96%Matridin-15-one, 11,12,13,14-tetradehydro-(4(1)S,7aS,13bS)-2,3,5,6,7,7a,8,13b-octahydro-1H-dipyrido[2,1-f:3',2',1'-ij][1,6]naphthyridin-10(4(1)H)-one1H,5H,10H-Dipyrido[2,1-f:3',2',1'-ij][1,6]naphthyridin-10-one, 2,3,6,7,7a,8,13b,13c-octahydro-, (7aS,13bS,13cS)-
AC1Q6CQPAC1L52YISOPHORAMINE 96%CHEBI:9198orb1984124CHEMBL3590540SCHEMBL27742473HY-N3198A
Database identifiers
- CAS
6882-66-2
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 23.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 440
Physicochemical properties
- Melting point
- 164 · 164-5°C
- Boiling point
- 455.6 · 455.6±34.0 °C(Predicted)
- Density
- 1.22 · 1.22±0.1 g/cm3(Predicted)
- pka
- 9.67 · 9.67±0.20(Predicted)
- NIST Chemistry Reference
- Sophoramine(6882-66-2)
Chemistry & industry
Applications
DescriptionAn alkaloid present in Sophora alopecuroides, the base possesses the tetracyclic structure characteristic of the Sophora alkaloids. It is 1aevorotatory with [α]D - 90.85° or - 98° (EtOH). It yields a series of well crystalline salts and derivatives including the hydrochloride, m.p. 247-8° (dec.); hydriodide, m.p. 294-6°C; aurichloride, m.p. 183-4°C (dec.); p1atinich1oride, m.p. 245-7°C (dec.); picrate, m.p. 229-231°C (dec.) and the picrolonate, m.p. 173-5°C (dec.).
UsesSophoramine is a quinolizidine alkaloid isolated from traditional Chinese herbal drugssuch as Sophora flavescens Ait. (Kushen), S. alopecuroides L. (Kudouzi or Kugancao) and S. tonkinensis Gapnep (Shandougen).
Suppliers22 total
湖北万得化工有限公司15377098680 15377098680 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
浙江珲达生物科技有限公司0571-89903022 18679456698 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
成都普菲德生物技术有限公司028-82610909 13388174823 · [email protected]
深圳虹彩祥根生物科技有限公司+86-0755-89668383 · [email protected]
湖北广奥生物科技有限公司027-02702759223056 18162699093 · [email protected]
贵州迪大科技有限责任公司0851-8475-2296 18096062265 · [email protected]
上海卓因生物科技有限公司
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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