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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP024028

ST 28:1;O;Hex;FA 18:1

Formula: C52H90O7  |  Mol. Weight: 827.30 g/mol

IUPAC: [6-[[17-(5,6-dimethylheptan-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-3,4,5-trihydroxyoxan-2-yl]methyl (Z)-octadec-9-enoate

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Overview

Molecular Formula C52H90O7
Molecular Weight 827.30 g/mol
Canonical SMILES CCCCCCCCC=CCCCCCCCC(=O)OCC1C(C(C(C(O1)OC2CCC3(C4CCC5(C(C4CC=C3C2)CCC5C(C)CCC(C)C(C)C)C)C)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy