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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP005013

(1R,3aR,5aR,5bR,7aR,9S,11aS,11bR,12R,13aR,13bS)-1-(2-hydroxypropan-2-yl)-3a,5a,5b,8,8,11a-hexamethyl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-9,12-diol

Formula: C30H52O3  |  Mol. Weight: 460.70 g/mol

IUPAC: (1R,3aR,5aR,5bR,7aR,9S,11aS,11bR,12R,13aR,13bS)-1-(2-hydroxypropan-2-yl)-3a,5a,5b,8,8,11a-hexamethyl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-9,12-diol

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Overview

Molecular Formula C30H52O3
Molecular Weight 460.70 g/mol
Canonical SMILES CC1(C2CCC3(C(C2(CCC1O)C)C(CC4C3(CCC5(C4C(CC5)C(C)(C)O)C)C)O)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy