(1R,6R,7S,8S,9R,10S,11R,12R,13S,16S,17R)-8-tert-butyl-6,9,12,17-tetrahydroxy-16-methyl-2,4,14,19-tetraoxahexacyclo[8.7.2.0¹,¹¹.0³,⁷.0⁷,¹¹.0¹³,¹⁷]nonadecane-5,15,18-trione | C20H24O11 | C[C@@H]1C(=O)O[C@H]2[C@H](O)[C@]34[C@@H]5OC(=O)[C@]3(OC3OC(=O)[C@H](O)[C@]43[C@@H]([C@H]5O)C(C)(C)C)[C@@]12O | ArZ-UP487432, CFN99639, CSC159261334, ZX-CY009208 | Chemspace

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Home CSSS00159261334

Structure Info

Chemspace ID: CSSS00159261334 (In-Stock Screening Compounds)

IUPAC Name: (1R,6R,7S,8S,9R,10S,11R,12R,13S,16S,17R)-8-tert-butyl-6,9,12,17-tetrahydroxy-16-methyl-2,4,14,19-tetraoxahexacyclo[8.7.2.0¹,¹¹.0³,⁷.0⁷,¹¹.0¹³,¹⁷]nonadecane-5,15,18-trione

Mol formula: C₂₀H₂₄O₁₁

Mol weight: 440 Da

Catalog Number(s): ArZ-UP487432, CFN99639, CSC159261334, ZX-CY009208

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SMILES
INCHI
INCHI key
MOL

Properties
SDS

Properties

LogP: -1.58

Heavy atoms count: 31

Rotatable bond count: 1

Number of rings: 6

Carbon bond saturation, Fsp3: 0.85

Polar surface area (Å): 169

Hydrogen bond acceptors count: 8

Hydrogen bond donors count: 4

: Zoom the structure; CSSS00159261334

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