(22R)-5,6beta,22,27-Tetrahydroxy-1-Oxo-5alpha-Ergosta-2,24-Dien-26-Oic Acid gamma-Lactone
[CAS# 19891-82-8]

Identification

• Name: (22R)-5,6beta,22,27-Tetrahydroxy-1-Oxo-5alpha-Ergosta-2,24-Dien-26-Oic Acid gamma-Lactone
• Synonyms: (6R)-6-[(1S)-1-[(5R,6R,8S,9S,10R,13S,14S,17R)-5,6-Dihydroxy-1-Keto-10,13-Dimethyl-6,7,8,9,11,12,14,15,16,17-Decahydro-4H-Cyclopenta[A]Phenanthren-17-Yl]Ethyl]-4-Methyl-3-Methylol-5,6-Dihydropyran-2-One; Acnistoferin; Jaborosalactone D
• Molecular Formula: C₂₈H₄₀O₆
• Molecular Weight: 472.62
• CAS Registry Number: 19891-82-8
• SMILES: [C@]45([C@@H]2[C@H]([C@@H]1CC[C@@H]([C@]1(CC2)C)[C@@H]([C@@H]3OC(=O)C(=C(C3)C)CO)C)C[C@H]([C@@]4(O)CC=CC5=O)O)C
• InChI: 1S/C28H40O6/c1-15-12-22(34-25(32)18(15)14-29)16(2)19-7-8-20-17-13-24(31)28(33)10-5-6-23(30)27(28,4)21(17)9-11-26(19,20)3/h5-6,16-17,19-22,24,29,31,33H,7-14H2,1-4H3/t16-,17-,19+,20-,21-,22+,24+,26+,27-,28-/m0/s1
• InChIKey: LDWRZKAVHDHGID-VZGLNVPESA-N