Cas no 84461-54-1 ((22R)-5β,6β-Epoxy-4β,12β,22,27-tetrahydroxy-1-oxo-5β-ergosta-2,24-dien-26-oic acid δ-lactone)

(22R)-5β,6β-Epoxy-4β,12β,22,27-tetrahydroxy-1-oxo-5β-ergosta-2,24-dien-26-oic acid δ-lactone structure
84461-54-1 structure
Product Name:(22R)-5β,6β-Epoxy-4β,12β,22,27-tetrahydroxy-1-oxo-5β-ergosta-2,24-dien-26-oic acid δ-lactone
CAS No:84461-54-1
MF:C28H38O7
MW:486.59712934494
CID:1823871
Update Time:2022-09-23

(22R)-5β,6β-Epoxy-4β,12β,22,27-tetrahydroxy-1-oxo-5β-ergosta-2,24-dien-26-oic acid δ-lactone Chemical and Physical Properties

Names and Identifiers

    • (22R)-5β,6β-Epoxy-4β,12β,22,27-tetrahydroxy-1-oxo-5β-ergosta-2,24-dien-26-oic acid δ-lactone
    • 12β-Hydroxywithaferin A
    • Inchi: 1S/C28H38O7/c1-13-9-20(34-25(33)16(13)12-29)14(2)17-5-6-18-15-10-24-28(35-24)22(31)8-7-21(30)27(28,4)19(15)11-23(32)26(17,18)3/h7-8,14-15,17-20,22-24,29,31-32H,5-6,9-12H2,1-4H3/t14-,15-,17+,18-,19-,20+,22-,23+,24+,26+,27-,28+/m0/s1
    • InChI Key: QTUMPYRKGLFMME-SDSVCERJSA-N
    • SMILES: O1[C@]2([H])C([H])([H])[C@@]3([H])[C@]4([H])C([H])([H])C([H])([H])[C@]([H])([C@]([H])(C([H])([H])[H])[C@@]5([H])C([H])([H])C(C([H])([H])[H])=C(C([H])([H])O[H])C(=O)O5)[C@@]4(C([H])([H])[H])[C@@]([H])(C([H])([H])[C@]3([H])[C@]3(C(C([H])=C([H])[C@@]([H])([C@]132)O[H])=O)C([H])([H])[H])O[H]
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