(3Z,5Z,9S,10S,12S,13S,14Z,19S,20R)-9,10,12,13-Tetrahydroxy-4,19-Dimethyl-8,11,17-Trimethylidene-20-[(2R,3S)-3-[(2S)-Pentan-2-Yl]Oxiran-2-Yl]-1-Oxacycloicosa-3,5,14-Trien-2-One
[CAS# 106463-75-6]

Identification

• Name: (3Z,5Z,9S,10S,12S,13S,14Z,19S,20R)-9,10,12,13-Tetrahydroxy-4,19-Dimethyl-8,11,17-Trimethylidene-20-[(2R,3S)-3-[(2S)-Pentan-2-Yl]Oxiran-2-Yl]-1-Oxacycloicosa-3,5,14-Trien-2-One
• Synonyms: (3Z,5Z,9S,10S,12S,13S,14Z,19S,20R)-9,10,12,13-Tetrahydroxy-4,19-Dimethyl-20-[(2R,3S)-3-[(1S)-1-Methylbutyl]Oxiran-2-Yl]-8,11,17-Trimethylene-1-Oxacycloicosa-3,5,14-Trien-2-One; (3Z,5Z,9S,10S,12S,13S,14Z,19S,20R)-9,10,12,13-Tetrahydroxy-4,19-Dimethyl-20-[(2R,3S)-3-[(1S)-1-Methylbutyl]-2-Oxiranyl]-8,11,17-Trimethylene-1-Oxacycloicosa-3,5,14-Trien-2-One; Amphidinolide A
• Molecular Formula: C₃₁H₄₆O₇
• Molecular Weight: 530.70
• CAS Registry Number: 106463-75-6
• SMILES: [C@H]1(O[C@H]1[C@H](CCC)C)[C@@H]2OC(=O)\C=C(/C=C\CC([C@H](O)[C@@H](O)C([C@H](O)[C@@H](O)\C=C/CC(C[C@@H]2C)=C)=C)=C)C
• InChI: 1S/C31H46O7/c1-8-11-21(5)29-31(38-29)30-22(6)16-18(2)13-10-15-24(32)27(35)23(7)28(36)26(34)20(4)14-9-12-19(3)17-25(33)37-30/h9-10,12,15,17,21-22,24,26-32,34-36H,2,4,7-8,11,13-14,16H2,1,3,5-6H3/b12-9-,15-10-,19-17-/t21-,22-,24-,26-,27-,28-,29-,30+,31+/m0/s1
• InChIKey: NFOKXEYWZUZJRF-FMZZXDJESA-N