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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP004417

Crocin-4

Formula: C27H36O9  |  Mol. Weight: 504.60 g/mol

IUPAC: 1-O-methyl 16-O-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (2E,4E,6E,8E,10E,12E,14E)-2,6,11,15-tetramethylhexadeca-2,4,6,8,10,12,14-heptaenedioate

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Overview

Molecular Formula C27H36O9
Molecular Weight 504.60 g/mol
Canonical SMILES CC(=CC=CC=C(C)C=CC=C(C)C(=O)OC1C(C(C(C(O1)CO)O)O)O)C=CC=C(C)C(=O)OC

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy