Leptinidine; 3-O-[β-D-Glucopyranosyl-(1→2)-β-D-glucopyranosyl-(1→4)-β-D-galactopyranoside] 

AlkaPlorer ID: AK304161

Synonym: Solanum Alkaloid SL-c

IUPAC Name: 2-[2-[4,5-dihydroxy-2-(hydroxymethyl)-6-[(18-hydroxy-10,14,16,20-tetramethyl-22-azahexacyclo[12.10.0.02,11.05,10.015,23.017,22]tetracos-4-en-7-yl)oxy]oxan-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol

Structure

SMILES: CC1CC(O)C2C(C)C3C(CC4C5CC=C6CC(OC7OC(CO)C(OC8OC(CO)C(O)C(O)C8OC8OC(CO)C(O)C(O)C8O)C(O)C7O)CCC6(C)C5CCC43C)N2C1

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InChI: InChI=1S/C45H73NO17/c1-18-11-26(50)31-19(2)30-25(46(31)14-18)13-24-22-6-5-20-12-21(7-9-44(20,3)23(22)8-10-45(24,30)4)58-41-38(57)36(55)39(29(17-49)61-41)62-43-40(35(54)33(52)28(16-48)60-43)63-42-37(56)34(53)32(51)27(15-47)59-42/h5,18-19,21-43,47-57H,6-17H2,1-4H3

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InChIKey: GVMQKQWPQVEEQC-UHFFFAOYSA-N

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Reference

PubChem CID: 162986553

COCONUT: CNP0259151.2

Source

Species Genus Family Order Class Phylum Kingdom Domain
Solanum lyratum Solanum Solanaceae Solanales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 900.0690000000001

TPSA: 281.15

MolLogP: -1.9015999999999889

Number of H-Donors: 11

Number of H-Acceptors: 18

RingCount: 9

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information