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name Structure Reference Source Properties Activities Metabolism

6-{[5-({5-[(3,5-dihydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl)oxy]-3-hydroxy-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}oxy)-4-hydroxy-2-{5',7,9,13-tetramethyl-5-oxaspiro[pentacyclo[10.8.0.0²,?.0?,?.0¹³,¹?]icosane-6,2'-piperidin]-18-eneoxy}oxan-3-yl]oxy}-2-methyl-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxane-3,4,5-triol

AlkaPlorer ID: AK016724

Synonym: None

IUPAC Name: 6-[5-[5-[3,5-dihydroxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3-hydroxy-5-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-4-hydroxy-2-(5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-piperidine]-16-yl)oxyoxan-3-yl]oxy-2-methyl-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxane-3,4,5-triol

Structure

SMILES: CC1CCC2(NC1)OC1CC3C4CC=C5CC(OC6OCC(OC7OCC(OC8OC(C)C(O)C(O)C8O)(OC8OCC(O)C(OC9OC(CO)C(O)C(O)C9O)C8O)CC7O)C(O)C6OC6OC(C)C(O)(OC7OC(C)C(O)C(O)C7O)C(O)C6O)CCC5(C)C4CCC3(C)C1C2C

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InChI: InChI=1S/C66H107NO32/c1-24-10-15-65(67-19-24)25(2)39-36(96-65)17-33-31-9-8-29-16-30(11-13-62(29,6)32(31)12-14-63(33,39)7)91-61-53(95-58-51(82)54(83)66(84,28(5)90-58)99-60-49(80)45(76)41(72)27(4)89-60)43(74)38(22-86-61)93-55-34(69)18-64(23-87-55,98-59-48(79)44(75)40(71)26(3)88-59)97-56-50(81)52(35(70)21-85-56)94-57-47(78)46(77)42(73)37(20-68)92-57/h8,24-28,30-61,67-84H,9-23H2,1-7H3

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InChIKey: WMDBRCVQFUPXMY-UHFFFAOYSA-N

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Source

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

Properties Information

Molecule Weight: 1426.5570000000007

TPSA？: 494.39000000000016

MolLogP？: -5.274400000000005

Number of H-Donors: 18

Number of H-Acceptors: 33

RingCount: 13

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information