Record Information
Version1.0
Creation date2018-04-16 08:20:25 UTC
Update date2018-04-27 10:10:10 UTC
FoodComEx IDPC001113
FoodDB RecordFDB013270
Chemical Information
NameTomatidine
DescriptionAlkaloid from Lycopersicon esculentum (tomato). Tomatidine is found in garden tomato, garden tomato (variety), and potato.
CAS Number77-59-8
Structure
Thumb
Synonyms
SynonymSource
(22S,25S)-5alpha-spirosolan-3beta-olbiospider
(3beta,5alpha,22beta,25S)-spirosolan-3-olbiospider
(3beta,5alpha,25S)-spirosolan-3-olbiospider
5α-Tomatidan-3β-olbiospider
5a-Tomatidan-3b-ol, 8CIdb_source
5alpha-tomatidan-3beta-olbiospider
5alpha-Tomatidan-3beta-ol (8CI)biospider
Spirosolan-3-olbiospider
Spirosolan-3-ol, (3α,22α-Tomatidan-3β-olbiospider
Spirosolan-3-ol, (3β,5α,22β,25S)-biospider
Spirosolan-3-ol, (3beta,5alpha,22beta,25S)-biospider
Spirosolan-3-ol, (3beta,5alpha,22beta,25S)- (9CI)biospider
Tomatidinbiospider
Tomatidinedb_source
Chemical FormulaC27H45NO2
IUPAC name5',7,9,13-tetramethyl-5-oxaspiro[pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosane-6,2'-piperidine]-16-ol
InChI IdentifierInChI=1S/C27H45NO2/c1-16-7-12-27(28-15-16)17(2)24-23(30-27)14-22-20-6-5-18-13-19(29)8-10-25(18,3)21(20)9-11-26(22,24)4/h16-24,28-29H,5-15H2,1-4H3
InChI KeyXYNPYHXGMWJBLV-UHFFFAOYSA-N
Isomeric SMILESCC1C2C(CC3C4CCC5CC(O)CCC5(C)C4CCC23C)OC11CCC(C)CN1
Average Molecular Weight415.6517
Monoisotopic Molecular Weight415.345029689
Chemical Taxonomy
ClassAlkaloids
Familysteroid alkaloids
Physico-Chemical Properties - Experimental
PropertyValueReference
Experimental logPNot Available
Experimental Water SolubilityNot Available
Melting PointMp 210-211°DFC
Foods of Origin
FoodContent Range AverageReference
FoodReference
Production Data
Production Methodcommercial
Production Method ReferenceNot Available
Production Method Reference FileNot Available
Quantity Available1 to 5 mg
Delivery Time2 weeks
Storage Formpowder
Storage Conditions4°C
StabilityNot Available
Purityunknown
Spectra
Spectral Data Upon RequestNot Available
Provider Information
Contact NameContact InstitutionContact Email
Claudine ManachINRA, Human Nutrition, Research Center Auvergne-Rhône-Alpes - Theix, Clermont-Ferrand, FR, F-63122claudine.manach@inra.fr
Commercial Vendors
AKSci 8282AH