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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP031364

(1S,2R,5R,7S,10R,12S,15R,16R,17S,18R,21R,22R,24R,25R)-1,6,6,15,17,20,20-heptamethyl-7-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-19,23-dioxaheptacyclo[13.10.0.02,12.05,10.010,12.016,24.018,22]pentacosane-21,22,25-triol

Formula: C35H56O10  |  Mol. Weight: 636.80 g/mol

IUPAC: (1S,2R,5R,7S,10R,12S,15R,16R,17S,18R,21R,22R,24R,25R)-1,6,6,15,17,20,20-heptamethyl-7-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-19,23-dioxaheptacyclo[13.10.0.02,12.05,10.010,12.016,24.018,22]pentacosane-21,22,25-triol

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Overview

Molecular Formula C35H56O10
Molecular Weight 636.80 g/mol
Canonical SMILES CC1C2C(C(C3(C2(CCC45C3CCC6C4(C5)CCC(C6(C)C)OC7C(C(C(CO7)O)O)O)C)C)O)OC8(C1OC(C8O)(C)C)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy