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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP038460

[3-[(9Z,12E,15E)-octadeca-9,12,15-trienoyl]oxy-2-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropyl] (9Z,12E,15E)-octadeca-9,12,15-trienoate

Formula: C45H74O10  |  Mol. Weight: 775.10 g/mol

IUPAC: [3-[(9Z,12E,15E)-octadeca-9,12,15-trienoyl]oxy-2-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropyl] (9Z,12E,15E)-octadeca-9,12,15-trienoate

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Overview

Molecular Formula C45H74O10
Molecular Weight 775.10 g/mol
Canonical SMILES CCC=CCC=CCC=CCCCCCCCC(=O)OCC(COC(=O)CCCCCCCC=CCC=CCC=CCC)OC1C(C(C(C(O1)CO)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy