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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP036171

Sabinene-hydrate (trans)

Formula: C59H102O6  |  Mol. Weight: 907.40 g/mol

IUPAC: [(2S)-2,3-di(heptadecanoyloxy)propyl] (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoate

Overview

Molecular Formula C59H102O6
Molecular Weight 907.40 g/mol
Canonical SMILES CCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCC=CCC=CCC=CCC=CCC=CCC=CCC)OC(=O)CCCCCCCCCCCCCCCC

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy