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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP006471

methyl 3-[(3S,3aR,5aR,6S,7S,9aR,9bR)-3-[(2R,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-6,9a,9b-trimethyl-7-prop-1-en-2-yl-1,2,3,3a,4,5,5a,7,8,9-decahydrocyclopenta[a]naphthalen-6-yl]propanoate

Formula: C31H52O4  |  Mol. Weight: 488.70 g/mol

IUPAC: methyl 3-[(3S,3aR,5aR,6S,7S,9aR,9bR)-3-[(2R,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-6,9a,9b-trimethyl-7-prop-1-en-2-yl-1,2,3,3a,4,5,5a,7,8,9-decahydrocyclopenta[a]naphthalen-6-yl]propanoate

Overview

Molecular Formula C31H52O4
Molecular Weight 488.70 g/mol
Canonical SMILES CC(=C)C1CCC2(C(C1(C)CCC(=O)OC)CCC3C2(CCC3C4(CCC(O4)C(C)(C)O)C)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy