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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP004212

(1S,2R,3R,7S,9S,12S,17R,18R,19R)-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24,25-trioxaheptacyclo[19.2.1.19,12.01,18.03,17.04,14.07,12]pentacos-4(14)-en-2-ol

Formula: C30H46O5  |  Mol. Weight: 486.70 g/mol

IUPAC: (1S,2R,3R,7S,9S,12S,17R,18R,19R)-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24,25-trioxaheptacyclo[19.2.1.19,12.01,18.03,17.04,14.07,12]pentacos-4(14)-en-2-ol

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Overview

Molecular Formula C30H46O5
Molecular Weight 486.70 g/mol
Canonical SMILES CC1CC2C(OC3(C1C4(CCC5=C(C4(C3O)C)CCC6C(C7CCC6(C5)O7)(C)C)C)O2)C(C)(C)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy