6-O-Acetylcoriatin

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For Research Use Only.

Category

Sesquiterpene

Cat.No.

NP5753

CAS

1432063-63-2

Product Name

6-O-Acetylcoriatin

Structure

Product Details

Description

6-O-Acetylcoriatin is a natural compound.

Synonyms

(1aR,1bS,2R,2'S,5S,6aS,7aS,8R)-rel-1b-(Acetyloxy)hexahydro-8-(1-hydroxy-1-methylethyl)-6a-methylspiro[2,5-methano-7H-oxireno[3,4]cyclopent[1,2-d]oxepin-7,2'-oxiran]-3(2H)-one

IUPAC Name

[12-(2-hydroxypropan-2-yl)-7-methyl-11-oxospiro[4,10-dioxatetracyclo[7.2.1.02,7.03,5]dodecane-6,2'-oxirane]-2-yl] acetate

Molecular Weight

338.4

Molecular Formula

C17H22O7

Canonical SMILES

CC(=O)OC12C3C(C(CC1(C4(CO4)C5C2O5)C)OC3=O)C(C)(C)O

InChI

InChI=1S/C17H22O7/c1-7(18)24-17-10-9(14(2,3)20)8(22-13(10)19)5-15(17,4)16(6-21-16)11-12(17)23-11/h8-12,20H,5-6H2,1-4H3

InChIKey

RCDCUCSJAPPGHK-UHFFFAOYSA-N

Boiling Point

504.7±50.0 °C(Predicted)

Purity

>98%

Density

1.43±0.1 g/cm3(Predicted)

Appearance

Powder

pKa

14.54±0.29(Predicted)

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