1-Oxohederagenin

Inquiry

For Research Use Only.

Category

Triterpenoids

Cat.No.

NP7076

CAS

618390-67-3

Product Name

1-Oxohederagenin

Structure

Product Details

Description

1-Oxohederagenin is a remarkable natural compound widely utilized in the biomedical sector, garnering significant attention due to its immense potential in the research of drug development targeting an array of ailments encompassing cancer, diabetes, inflammation and cardiovascular disorders.

Synonyms

3β,23-Dihydroxy-1-oxo-olean-12-en-28-oic acid

IUPAC Name

(4aS,6aS,6aS,6bR,8aS,9R,10S,12aR,14bS)-10-hydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-12-oxo-3,4,5,6,6a,7,8,8a,10,11,13,14b-dodecahydro-1H-picene-4a-carboxylic acid

Molecular Weight

486.68

Molecular Formula

C30H46O5

Canonical SMILES

CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(C(=O)CC(C5(C)CO)O)C)C)C2C1)C)C(=O)O)C

InChI

InChI=1S/C30H46O5/c1-25(2)11-13-30(24(34)35)14-12-27(4)18(19(30)16-25)7-8-21-28(27,5)10-9-20-26(3,17-31)22(32)15-23(33)29(20,21)6/h7,19-22,31-32H,8-17H2,1-6H3,(H,34,35)/t19-,20-,21-,22-,26-,27+,28+,29-,30-/m0/s1

InChIKey

BYWZDPHXZQSASO-DLRRJOOFSA-N

Boiling Point

620.2±55.0 °C at 760 mmHg

Melting Point

245-247°C

Purity

97%

Density

1.19±0.1 g/cm3

Form

Powder

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