Delgrandine

For Research Use Only.
Category
Alkaloids
Cat.No.
NP0664
CAS
145237-05-4
Product Name
Delgrandine
Structure

Product Details

Description
Delgrandine is an alkaloid isolated from Delphinium davidii.
Synonyms
Delgradine
IUPAC Name
(4,6,18-triacetyloxy-5-benzoyloxy-7-formyl-17-hydroxy-7,10-dimethyl-15-methylidene-10-azahexacyclo[7.7.1.12,14.01,12.03,8.03,11]octadecan-13-yl) benzoate
Molecular Weight
741.79
Molecular Formula
C41H43NO12
Canonical SMILES
CC(=O)OC1C2C(C3C4C56C1C3(CC2=C)C(C(C5C(C(C(C6OC(=O)C)OC(=O)C7=CC=CC=C7)OC(=O)C)(C)C=O)N4C)O)OC(=O)C8=CC=CC=C8
InChI
InChI=1S/C41H43NO12/c1-19-17-40-26-28(53-37(48)23-13-9-7-10-14-23)25(19)29(50-20(2)44)32(40)41-31(27(34(40)47)42(6)33(26)41)39(5,18-43)35(51-21(3)45)30(36(41)52-22(4)46)54-38(49)24-15-11-8-12-16-24/h7-16,18,25-36,47H,1,17H2,2-6H3/t25-,26?,27+,28-,29+,30?,31+,32+,33+,34+,35-,36?,39-,40-,41+/m0/s1
InChIKey
XDDAEJYWWRYPIF-PWXQXWHXSA-N
Purity
98.0%
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Packaging
1 mg
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