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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP017775

(10S,11R,12R,15R)-3,4,5,11,12,13,21,22,23,27,39,40-dodecahydroxy-9,14,17,25,31,36-hexaoxaoctacyclo[30.6.2.02,7.010,15.019,24.026,35.029,34.033,38]tetraconta-1(39),2,4,6,19,21,23,26,28,32(40),33(38),34-dodecaene-8,18,30,37-tetrone

Formula: C34H22O22  |  Mol. Weight: 782.50 g/mol

IUPAC: (10S,11R,12R,15R)-3,4,5,11,12,13,21,22,23,27,39,40-dodecahydroxy-9,14,17,25,31,36-hexaoxaoctacyclo[30.6.2.02,7.010,15.019,24.026,35.029,34.033,38]tetraconta-1(39),2,4,6,19,21,23,26,28,32(40),33(38),34-dodecaene-8,18,30,37-tetrone

Overview

Molecular Formula C34H22O22
Molecular Weight 782.50 g/mol
Canonical SMILES C1C2C(C(C(C(O2)O)O)O)OC(=O)C3=CC(=C(C(=C3C4=C(C(=C5C6=C4C(=O)OC7=C6C(=CC(=C7OC8=C(C(=C(C=C8C(=O)O1)O)O)O)O)C(=O)O5)O)O)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy