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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP018407

(3R,6S,8S,12R,15R,16R)-15-[(2R,5R)-5,6-dihydroxy-6-methyl-4-oxoheptan-2-yl]-3-hydroxy-7,7,12,16-tetramethyl-6-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxytetracyclo[9.7.0.03,8.012,16]octadeca-1(18),10-dien-14-one

Formula: C35H54O10  |  Mol. Weight: 634.80 g/mol

IUPAC: (3R,6S,8S,12R,15R,16R)-15-[(2R,5R)-5,6-dihydroxy-6-methyl-4-oxoheptan-2-yl]-3-hydroxy-7,7,12,16-tetramethyl-6-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxytetracyclo[9.7.0.03,8.012,16]octadeca-1(18),10-dien-14-one

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Overview

Molecular Formula C35H54O10
Molecular Weight 634.80 g/mol
Canonical SMILES CC(CC(=O)C(C(C)(C)O)O)C1C(=O)CC2(C1(CC=C3C2=CCC4C(C(CCC4(C3)O)OC5C(C(C(CO5)O)O)O)(C)C)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy