Loading...
Chemical structure of Thevetin B

GC76277

Thevetin B

Also known as 3-[(3S,5R,8R,9S,10S,13R,14S,17R)-14-hydroxy-3-[(2R,3S,4S,5S,6S)-3-hydroxy-4-methoxy-6-methyl-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyoxan-2-yl]oxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one

Thevetin B (compound 1) is a betalain isolated from Thevetia peruviana

ChemicalCAS27127-79-3MW858.96FormulaC42H66O18
CAS number
27127-79-3
Molecular weight
858.96
Formula
C42H66O18
InChIKey
GZVMBXDQUQRICT-RCGIHWJFSA-N
Catalogue number
GC76277
Brand
GLPBIO
Computed properties PubChem CID 441850 · XLogP -1.6 · TPSA 273 Ų · H-bond donors 9
XLogP
-1.6
TPSA
273 Ų
H-bond donors
9
H-bond acceptors
18
Rotatable bonds
10
Heavy atoms
60

SMILES C[C@H]1[C@@H]([C@H]([C@@H]([C@@H](O1)O[C@H]2CC[C@]3([C@@H](C2)CC[C@@H]4[C@@H]3CC[C@]5([C@@]4(CC[C@@H]5C6=CC(=O)OC6)O)C)C)O)OC)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O)O)O)O

Computed descriptors from PubChem (CID 441850), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
Ships from the manufacturer to your lab in 8–14 business days; customs and cold chain handled by LABO Scientific.
Pricing
Quoted in ILS, excl. VAT. Add the item to your quote and we confirm the final price, usually the same business day.
Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
Who we serve
Universities, hospitals and biotech companies across Israel. Research use only — not for diagnostic or therapeutic use.