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carasinol B

Structure via PubChem · Public domain (PubChem)

EntityQ55240· pop 8· linked from 27 articles

carasinol B

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chemical compound

In the Vinony graph

Within Vinony's link graph, carasinol B is referenced by 27 other articles, and connects out to digital object identifier, chemical formula and molar mass.

It is catalogued under topics including Chembox image size set, Natural phenol tetramers and Resveratrol oligomers.

Its subject is documented across 8 Wikipedia language editions.

Chemical data

Formula: C56H44O13
Molecular weight: 924.9 g/mol
IUPAC name: 5-[(2S,3R,4S,5R)-4-[(2S,3S)-3-[(2R,3R)-3-(3,5-dihydroxyphenyl)-6-hydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-1-benzofuran-4-yl]-6-hydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-1-benzofuran-4-yl]-2,5-bis(4-hydroxyphenyl)oxolan-3-yl]benzene-1,3-diol
SMILES: C1=CC(=CC=C1[C@@H]2[C@H]([C@H]([C@@H](O2)C3=CC=C(C=C3)O)C4=C5[C@@H]([C@H](OC5=CC(=C4)O)C6=CC=C(C=C6)O)C7=C8[C@H]([C@@H](OC8=CC(=C7)O)C9=CC=C(C=C9)O)C1=CC(=CC(=C1)O)O)C1=CC(=CC(=C1)O)O)O
InChIKey: RAUCCLKIJHMTND-HFRYPGABSA-N
XLogP: 8.8
Polar surface area: 230 Å²
H-bond donors: 10
H-bond acceptors: 13
Formal charge: 0

via PubChem

Wikidata facts

Mass: 924.278191

Show 4 more facts

chemical formula: C₅₆H₄₄O₁₃
canonical SMILES: C1=CC(=CC=C1C2C(C(C(O2)C3=CC=C(C=C3)O)C4=CC(=CC5=C4C(C(O5)C6=CC=C(C=C6)O)C7=CC(=CC8=C7C(C(O8)C9=CC=C(C=C9)O)C1=CC(=CC(=C1)O)O)O)O)C1=CC(=CC(=C1)O)O)O
isomeric SMILES: C1=CC(=CC=C1[C@@H]2[C@H]([C@H]([C@@H](O2)C3=CC=C(C=C3)O)C4=CC(=CC5=C4[C@@H]([C@H](O5)C6=CC=C(C=C6)O)C7=CC(=CC8=C7[C@H]([C@@H](O8)C9=CC=C(C=C9)O)C1=CC(=CC(=C1)O)O)O)O)C1=CC(=CC(=C1)O)O)O
found in taxon: Caragana sinica

Sources (2)

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Categories

Chembox image size set Natural phenol tetramers Resveratrol oligomers