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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP009606

[(2S,4aS,4bR,7S,8S,8aR,10aR)-4',5'-diacetyloxy-6'-chloro-1,1,4a,7,7',8a-hexamethylspiro[2,3,4,4b,5,6,7,9,10,10a-decahydrophenanthrene-8,2'-3H-1-benzofuran]-2-yl] acetate

Formula: C33H45ClO7  |  Mol. Weight: 589.20 g/mol

IUPAC: [(2S,4aS,4bR,7S,8S,8aR,10aR)-4',5'-diacetyloxy-6'-chloro-1,1,4a,7,7',8a-hexamethylspiro[2,3,4,4b,5,6,7,9,10,10a-decahydrophenanthrene-8,2'-3H-1-benzofuran]-2-yl] acetate

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Overview

Molecular Formula C33H45ClO7
Molecular Weight 589.20 g/mol
Canonical SMILES CC1CCC2C3(CCC(C(C3CCC2(C14CC5=C(C(=C(C(=C5O4)C)Cl)OC(=O)C)OC(=O)C)C)(C)C)OC(=O)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy