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512-06-1

512-06-1 Structure

512-06-1 Structure
IdentificationBack Directory
[Name]

(20α,22R,25S)-Spirosta-5-ene-3β-ol
[CAS]

512-06-1
[Synonyms]

Yamogenin
Diosgenin
Nsc 226132
Neodiosgenin
(25S)-Spirost-5-en-3β-ol
Spirost-5-en-3-ol, (3β,25S)-
Spirost-5-en-3-ol, (3beta,25S)-
(20α,22R,25S)-Spirosta-5-ene-3β-ol
(20α,22R,25S)-Spirosta-5-ene-3β-ol
[EINECS(EC#)]

208-134-3
[Molecular Formula]

C27H42O3
[MDL Number]

MFCD20377911
[MOL File]

512-06-1.mol
[Molecular Weight]

414.626
Chemical PropertiesBack Directory
[Melting point ]

>180°C (dec.)
[Boiling point ]

527.1±50.0 °C(Predicted)
[density ]

1.13±0.1 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,Room Temperature
[solubility ]

Chloroform (Sparingly), Ethyl Acetate (Slightly), Methanol (Slightly), Pyridine
[form ]

Solid
[pka]

15.02±0.70(Predicted)
[color ]

White to Pale Beige
[Major Application]

food and beverages
[InChIKey]

WQLVFSAGQJTQCK-MIRLUMJSSA-N
[SMILES]

C[C@@H]1CO[C@]2([C@@H](C)[C@H]3[C@H](C[C@@H]4C3(C)CC[C@H]3[C@H]4CC=C4[C@]3(C)CC[C@H](O)C4)O2)CC1
Safety DataBack Directory
[WGK Germany ]

WGK 3
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Uses]

Yamogenin is a sapogenin compound found in the plant amber fenugreek, with steroid framework, that maintains antidiabetogenic activity. They also provide framework for the synthesis of a potential inhibitor of metallo-β-lactamase-1 which is a major target in the treatment of diseases involving gram-negative bacteria.
[Definition]

ChEBI: Yamogenin is a triterpenoid.
Spectrum DetailBack Directory
[Spectrum Detail]

(20α,22R,25S)-Spirosta-5-ene-3β-ol(512-06-1)1HNMR
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