4-O-Methylcryptochlorophaeic acid

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4-O-Methylcryptochlorophaeic acid
Category Enzyme inhibitors
Catalog number BBF-05114
CAS 27587-68-4
Molecular Weight 474.54
Molecular Formula C26H34O8

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Description

4-O-Methylcryptochlorophaeic acid is a potent inhibitor of prostaglandin biosynthesis.

Specification

Synonyms Benzoic acid, 3-((2,4-dimethoxy-6-pentylbenzoyl)oxy)-2,4-dihydroxy-6-pentyl-
IUPAC Name 3-(2,4-dimethoxy-6-pentylbenzoyl)oxy-2,4-dihydroxy-6-pentylbenzoic acid
Canonical SMILES CCCCCC1=CC(=C(C(=C1C(=O)O)O)OC(=O)C2=C(C=C(C=C2OC)OC)CCCCC)O
InChI InChI=1S/C26H34O8/c1-5-7-9-11-16-13-18(32-3)15-20(33-4)21(16)26(31)34-24-19(27)14-17(12-10-8-6-2)22(23(24)28)25(29)30/h13-15,27-28H,5-12H2,1-4H3,(H,29,30)
InChI Key LWJWHWGMUBQMKG-UHFFFAOYSA-N

Properties

Boiling Point 626.2±55.0°C (Predicted)
Melting Point 141.5-142°C
Density 1.201±0.06 g/cm3 (Predicted)

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Tip: Chemical formula is case sensitive. C22H30N4O c22h30n40
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