4-Dehydrowith­aferin A CAS 5119-48-2

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Iden­ti­fi­ca­tion

CAS Number

5119-48-2

Name

4-Dehydrowith­­aferin A

Syn­onyms

(4b,5b,6b,22R)-5,6-Epoxy-4,22,27-trihydroxy-1-oxoergosta-2,24-dien-26-oic acid d-lac­­tone
(4β,5β,6β,22R)-4,27-Dihydroxy-5,6:22,26-diepoxyergosta-2,24-dien-1,26-dion [Ger­man] [ACD/IUPAC Name]
(4β,5β,6β,22R)-4,27-Dihydroxy-5,6:22,26-diepoxyergosta-2,24-diene-1,26-dione [ACD/IUPAC Name]
(4β,5β,6β,22R)-4,27-Dihydroxy-5,6:22,26-diépoxyergosta-2,24-diène-1,26-dione [French] [ACD/IUPAC Name]
4b,27-Dihydroxy-1-oxo-5b,6b-epoxywitha-2,24-dienolide
4β,5β,6β,22R)-5,6-Epoxy-4,22,27-trihydroxy-1-oxo-ergosta-2,24-dien-26-oic acid δ-lac­­tone
5,6-Epoxy-4,22,27-trihydroxy-1-oxoergosta-2,24-dien-26-oic Acid d-Lac­­tone
5,6-Epoxy-4,27-dihydroxy-1-oxowitha-2,24-dienolide
5119-48-2 [RN]
Ergosta-2,24-diene-1,26-dione, 5,6:22,26-diepoxy-4,27-dihydroxy-, (4β,5β,6β,22R)- [ACD/​Index Name]
MFCD10687098
With­aferin A
With­afer­ine
With­afer­ine A
(3E,6E)-3,7,11-Trimethyldodeca-1,3,6,10-tetraene [ACD/IUPAC Name]
(4?,5?,6?,22R)-4,27-Dihydroxy-5,6:22,26-diepoxyergosta-2,24-diene-1,26-dione
(4??,5??,6??,22R)-4,27-Dihydroxy-5,6:22,26-diepoxyergosta-2,24-diene-1,26-dione
(4S,4aR,5aR,6aS,6bS,9R,9aS,11aS,11bR)-4-hydroxy-9-((S)-1-((R)-5-(hydroxymethyl)-4-methyl-6-oxo-3,6-dihydro-2H-pyran-2-yl)ethyl)-9a,11b-dimethyl-5a,6,6a,6b,7,8,9,9a,10,11,11a,11b-dodecahydrocyclopenta[
(4ß,5ß,6ß,22R)-4,27-Dihydroxy-5,6:22,26-diepoxyergosta-2,24-diene-1,26-dione
[5119-48-2]
1,2]phenanthro[8a,9-b]oxiren-1(4H)-one
4β,27-dihydroxy-1-oxo-5β,6β-epoxywitha-2,24-dienolide
5β,6β-epoxy-4β,22R,27-trihydroxy-1-oxo-δ-lactone-ergosta-2,24-dien-26-oic acid
5β-Ergosta-2,24-dien-26-oic acid, 5,6β-epoxy-4β,22, 27-tri­hy­­droxy-1-oxo-, δ-lac­­tone, (20S,22R)-
5β-Ergosta-2,24-dien-26-oic acid, 5,6β-epoxy-4β,22,27-trihydroxy-1-oxo-, δ-lac­­tone, (20S,22R)-
Ergosta-2,24-dien-26-oic acid, 5,6-epoxy-4,22, 27-tri­hy­­droxy-1-oxo-, δ-lac­­tone, (4β,5β,6β, 22R)-
Ergosta-2,24-dien-26-oic acid, 5,6-epoxy-4,22,27-trihydroxy-1-oxo-, δ-lac­­tone, (4β,5β,6β,22R)-
http:////www.amadischem.com/proen/601587/
https://​www​.ebi​.ac​.uk/​c​h​e​b​i​/​s​e​a​r​c​h​I​d​.​d​o​?​c​h​e​b​i​I​d​=​C​H​E​B​I​:​6​9​120
WFA
With­aferin A 100 µg/mL in Ace­toni­trile
with­aferin a stan­dard
With­aferin A, With­a­nia som­nifera – CAS 5119-48-2 – Cal­biochem
WITH­AFERIN DERIV JPR, IOWA U. COM­POUND
WITH­AFE­RI­NA
WLN : T3 F5 E666 1A R AXO OV PU CH&TTT­TJ J1 N1 RQ IY1&- FT6OV CUTJ C1Q D1

SMILES

CC1=C(C(=O)O[C@H](C1)[C@@H](C)[C@H]2CC[C@@H]3[C@@]2(CC[C@H]4[C@H]3C[C@@H]5[C@]6([C@@]4(C(=O)C=C[C@@H]6O)C)O5)C)CO

Std­InChI

InChI=1S/C28H38O6/c1-14-11-21(33-25(32)17(14)13-29)15(2)18-5-6-19-16-12-24-28(34-24)23(31)8-7-22(30)27(28,4)20(16)9-10-26(18,19)3/h7-8,15-16,18-21,23-24,29,31H,5-6,9-13H2,1-4H3/t15-,16-,18+,19-,20-,21+,23-,24+,26+,27-,28+/m0/s1

Std­InChIKey

DBRX­OU­CR­JQVYJQ-CKN­­DU­UL­B­SA-N

Mol­e­c­u­lar Formula

C₂₈H₃₈O₆

Mol­e­c­u­lar Weight

470.60

Prop­er­ties

Appear­ance

White to off white powder

Safe­ty Data

RIDADR 

NONH for all modes of transport

WGK Germany

3

Spec­i­fi­ca­tions and Oth­er Infor­ma­tion of Our 4-Dehydrowith­­aferin A CAS 5119-48-2

Iden­ti­fi­ca­tion Methods

1HNMR, 13CNMR

Puri­ty

98% min

Shelf Life

2 years

Stor­age

Under room tem­per­a­ture away from light

Known Appli­ca­tion

Often used as phar­ma­ceu­ti­cal intermediates.

Gen­er­al View of Documents

Links

This prod­uct is devel­oped by our R&D com­pa­ny Cam­ing Phar­ma­ceu­ti­cal Ltd (https://​www​.cam​ing​.com/).

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