CAS:121521-90-2 | lithospermic acid B
Synonyms:
4-{(E)-2-[1-Carboxy-2-(3,4-dihydroxy-phenyl)-ethoxycarbonyl]-vinyl}-2-(3,4-dihydroxy-phenyl)-7-hydroxy-2,3-dihydro-benzofuran-3-carboxylic acid 2-carboxy-3-(3,4-dihydroxy-phenyl)-propyl ester;Aids096006;Aids-096006
Canonical SMILES: C1=CC(=C(C=C1CC(C(=O)O)OC(=O)C=CC2=C3C(C(OC3=C(C=C2)O)C4=CC(=C(C=C4)O)O)C(=O)OC(CC5=CC(=C(C=C5)O)O)C(=O)O)O)O
HS Code: 29329990
Density:1.637±0.06g/cm3(Predicted)
Boiling Point:1020.3±65.0°C(Predicted)
Melting Point: 98-110°C
Storage: -20°CFreezer
PKA: 2.77±0.10(Predicted)
Appearance: powder
Safety Statements: 24/25
WGK Germany: 3
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