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Chemical structure of 6-Deoxyjacareubin

GC76326

6-Deoxyjacareubin

Also known as 5,10-dihydroxy-2,2-dimethylpyrano[3,2-b]xanthen-6-one

6-Deoxyjacareubin is a natural xanthone, that can be isolated from the leaves of Vismia latifolia

ChemicalCAS16265-56-8MW310.3FormulaC18H14O5
CAS number
16265-56-8
Molecular weight
310.3
Formula
C18H14O5
InChIKey
NHNIESSJWQBRJW-UHFFFAOYSA-N
Catalogue number
GC76326
Brand
GLPBIO
Computed properties PubChem CID 5281629 · XLogP 3.7 · TPSA 76 Ų · H-bond donors 2
XLogP
3.7
TPSA
76 Ų
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
0
Heavy atoms
23

SMILES CC1(C=CC2=C(O1)C=C3C(=C2O)C(=O)C4=C(O3)C(=CC=C4)O)C

Computed descriptors from PubChem (CID 5281629), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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