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Hupehenine

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Name

Hupehenine

EINECS N/A
CAS No. 98243-57-3 Density 1.133g/cm3
PSA 43.70000 LogP 4.50110
Solubility N/A Melting Point 181-182 °C
Formula C27H45 N O2 Boiling Point 538.039oC at 760 mmHg
Molecular Weight 415.66 Flash Point 250.376oC
Transport Information N/A Appearance N/A
Safety 24/25 Risk Codes N/A
Molecular Structure Molecular Structure of 98243-57-3 (HUPEHENINE) Hazard Symbols N/A
Synonyms

20-Deoxy-17-epiisoverticine;5a,14a,17b-Cevanine-3b,6b-diol; Delavine; Hupehenine

Article Data 4

Hupehenine Chemical Properties

Molecular Structure of Hupehenine (CAS NO.98243-57-3):

Systematic Name: (3beta,5alpha,6beta,17beta)-Cevane-3,6-diol 
Molecular Formula: C27H45NO2
Molecular Weight: 415.65
CAS Registry Number: 98243-57-3 
H bond acceptors: 3
H bond donors: 2
Freely Rotating Bonds: 2
Index of Refraction: 1.577
Molar Refractivity: 121.507 cm3
Molar Volume: 366.899 cm3
Surface Tension: 48.243 dyne/cm
Density: 1.133 g/cm3
Flash Point: 250.376 °C
Enthalpy of Vaporization: 93.737 kJ/mol
Boiling Point: 538.039 °C at 760 mmHg
Vapour Pressure: 0 mmHg at 25 °C
SMILES: O[C@@H]5C[C@@H]6[C@H](O)C[C@@H]4[C@H](C[C@@H]1[C@H]4CC[C@H]2[C@@H](C)[C@@H]3CC[C@H](C)CN3C[C@@H]12)[C@@]6(C)CC5
InChI: InChI=1/C27H45NO2/c1-15-4-7-25-16(2)18-5-6-19-20(22(18)14-28(25)13-15)11-23-21(19)12-26(30)24-10-17(29)8-9-27(23,24)3/h15-26,29-30H,4-14H2,1-3H3/t15-,16+,17-,18-,19+,20+,21-,22+,23-,24+,25-,26+,27+/m0/s1
InChIKey: NEMWYOKGHGSVSC-MSSYMPDSBN

Hupehenine Specification

 Hupehenine (CAS NO.98243-57-3), its Synonyms are (3beta,5alpha,6beta,17beta)-Cevane-3,6-diol ; Cevane-3,6-diol, (3beta,5alpha,6beta,17beta)- ; 20-Deoxy-17-epiisoverticine ; 5alpha,14alpha,17beta-Cevanine-3beta,6beta-diol ; Delavine .
 The quantitative analysis of Hupehenine has  developed by A reverse-phase high pressure liquid chromatography (HPLC) method with evaporative light scattering detection (ELSD) in the total alkaloids from Fritillaria hupehensis.

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