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29-Hydroxy-25,29-dioxoolean-18-en-3-yl 2-O-pentopyranosylhexopyranosiduronic acid

HCID 192588
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Basic information

CAS
152464-84-1
Standard SMILES
CC1(C(=O)O)C=C2C3CCC4C5(C=O)CCC(OC6OC(C(=O)O)C(O)C(O)C6OC6OCC(O)C(O)C6O)C(C)(C)C5CCC4(C)C3(C)CCC2(C)CC1
InChIKey
OHGFKHHCPIGSKE-UHFFFAOYSA-N
Molecular formula
C41H62O14
Average molar mass
778.933 g/mol
Monoisotopic mass
778.41395666

Names & identifiers

Preferred name
29-Hydroxy-25,29-dioxoolean-18-en-3-yl 2-O-pentopyranosylhexopyranosiduronic acid
IUPAC
29-Hydroxy-25,29-dioxoolean-18-en-3-yl 2-O-pentopyranosylhexopyranosiduronic acid
English name
periandrin V
Molecular formula
C41H62O14
Molecular weight
778.92

Names & synonyms

periandrin Vβ-D-Glucopyranosiduronic acid, (3β,20β)-20-carboxy-25-oxo-30-norolean-18-en-3-yl 2-O-β-D-xylopyranosyl-

Database identifiers

CAS
152464-84-1
PubChem CID
192588
DTXSID
DTXSID30934506
ChEBI
CHEBI:180644

Properties

Physicochemical properties

Boiling point
900.8 · 900.8±65.0 °C(predicted)
Density
1.38 · 1.38±0.1 g/cm3(Temp: 20 °C; Press: 760 Torr)(predicted)
pka
2.76 · 2.76±0.70(predicted)

Chemistry & industry

Suppliers1 total

TargetMol中国(陶术生物)15002134094 · [email protected]

Additional notes

DefinitionChEBI: Periandrin V is a triterpenoid saponin.

Related reactions

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Compound notes

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