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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP029991

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

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

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

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Overview

Molecular Formula C30H52O3
Molecular Weight 460.70 g/mol
Canonical SMILES CC1(C2CCC3(C(C2(C(CC1O)O)C)CCC4C3(CCC5C4(CCC5C(C)(C)O)C)C)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy