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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP000401

(3I(2),4I+/-,16I+/-,22I+/-)-Olean-12-ene-3,16,22,23,28-pentol

Formula: C30H50O5  |  Mol. Weight: 490.70 g/mol

IUPAC: (3S,4R,4aR,6aR,6bS,8R,8aS,9S,12aS,14aR,14bR)-4,8a-bis(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-3,8,9-triol

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Overview

Molecular Formula C30H50O5
Molecular Weight 490.70 g/mol
Canonical SMILES CC1(CC2C3=CCC4C5(CCC(C(C5CCC4(C3(CC(C2(C(C1)O)CO)O)C)C)(C)CO)O)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy