Compound BIMP037394

[(1S,3R,4R,5R,6S,10S,12S,16R,18S,21R)-4,6,12,17,17-pentamethyl-8-(2-methylpropanoyl)-18-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosa-7,13-dien-3-yl] acetate

Formula: C₃₇H₅₄O₉ | Mol. Weight: 642.80 g/mol

IUPAC: [(1S,3R,4R,5R,6S,10S,12S,16R,18S,21R)-4,6,12,17,17-pentamethyl-8-(2-methylpropanoyl)-18-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosa-7,13-dien-3-yl] acetate

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Overview

Molecular Formula C₃₇H₅₄O₉

Molecular Weight 642.80 g/mol

Canonical SMILES CC1C=C(OC2C1C3(C(CC45CC46CCC(C(C6CC=C5C3(C2)C)(C)C)OC7C(C(C(CO7)O)O)O)OC(=O)C)C)C(=O)C(C)C

Bioactivity of Indian Medicinal Plants

[(1S,3R,4R,5R,6S,10S,12S,16R,18S,21R)-4,6,12,17,17-pentamethyl-8-(2-methylpropanoyl)-18-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosa-7,13-dien-3-yl] acetate

Overview

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

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