HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program：[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
Back
HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 178750737Generated: October 30, 2026

1-Acetyltrichilinin

1-Acetyltrichilinin · 24-Norchola-5,14,20,22-tetraeno[6,5,4-bc]furan-1,3,7,12-tetrol, 21,23-epoxy-4,5,5',6-tetrahydro-4,8-dimethyl-, 1,3,12-triacetate, (1α,3α,4β,5β,6β,7α,12α,13α,17α)-

https://huagongshe.com/en/chemical/178750737

1-Acetyltrichilinin molecular structure

Identifiers & Physical Properties

CAS No.117842-14-5
Molecular formulaC32H42O9
Average molar mass570.7 g/mol
SMILESCC(=O)O[C@H]1C[C@H]2[C@](C)(C3=CC[C@@H](c4ccoc4)[C@@]31C)[C@H](O)[C@@H]1OC[C@@]3(C)[C@@H]1[C@]2(C)[C@@H](OC(C)=O)C[C@H]3OC(C)=O
InChIKeySAEWWOQZFBDINP-CNTUVSRUSA-N

Chemical & Physical Properties

XLogP3.5
Topological polar surface area122
Hydrogen bond donors1
Hydrogen bond acceptors9
Rotatable bonds7
Heavy atoms41
Formal charge0
Complexity1,170
Boiling point614.4±55.0 °C(Predicted)
Density1.28±0.1 g/cm3(Predicted)
pKa (acidity coefficient)13.37±0.70(Predicted)

Applications & Uses

Uses

1-Acetyltrichilinin is a limonoid that can be isolated from the fruit of Melia toosendan and is a biosynthetic precursor of voltagenin[1][2].