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Isofumigaclavine A
[CAS# 58800-19-4]

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CAS#: 58800-19-4
Product: Isofumigaclavine A
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Identification
Name Isofumigaclavine A
Synonyms Ergolin-9-Ol, 6,8-Dimethyl-, Acetate (Ester), (8Beta,9Alpha)-; Isofumigaclavine A
Molecular Structure CAS#: 58800-19-4, Isofumigaclavine A
Molecular Formula C18H22N2O2
Molecular Weight 298.38
CAS Registry Number 58800-19-4
SMILES [C@@H]14C([C@@H]([C@H](CN1C)C)OC(=O)C)C2=C3C(=CC=C2)[NH]C=C3C4
InChI 1S/C18H22N2O2/c1-10-9-20(3)15-7-12-8-19-14-6-4-5-13(16(12)14)17(15)18(10)22-11(2)21/h4-6,8,10,15,17-19H,7,9H2,1-3H3/t10-,15+,17?,18+/m0/s1
InChIKey GJSSYQDXZLZOLR-HQNFJNNYSA-N
Properties
Density 1.236g/cm3 (Cal.)
Boiling point 456.943°C at 760 mmHg (Cal.)
Flash point 230.151°C (Cal.)
Market Analysis Reports
List of Reports Available for Isofumigaclavine A
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