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Chemical structure of Rhein-13C4

GC45798

Rhein-13C4

Also known as 4,5-dihydroxy-9,10-dioxoanthracene-2-carboxylic acid

An internal standard for the quantification of rhein

ChemicalCAS1189928-10-6MW288.2FormulaC11[13C4]H8O6
CAS number
1189928-10-6
Molecular weight
288.2
Formula
C11[13C4]H8O6
Solubility
Soluble in DMSO
InChIKey
FCDLCPWAQCPTKC-AGPBJXDCSA-N
Catalogue number
GC45798
Brand
GLPBIO
Computed properties PubChem CID 46782876 · XLogP 2.2 · TPSA 112 Ų · H-bond donors 3
XLogP
2.2
TPSA
112 Ų
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
1
Heavy atoms
21

SMILES C1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)[13CH]=C([13CH]=[13C]3O)[13C](=O)O

Computed descriptors from PubChem (CID 46782876), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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