Trichosporin B-Ia
[CAS# 107395-30-2]

Identification

• Name: Trichosporin B-Ia
• Synonyms: Trichosporin B-Ia
• Molecular Formula: C₉₁H₁₅₁N₂₃O₂₅
• Molecular Weight: 1967.33
• CAS Registry Number: 107395-30-2
• SMILES: C2=C(CC(NC(C(NC(C(NC(C(NC(C(NC(C(NC(C1N(C(C(NC(C(CC(C)C)NC(=O)CNC(=O)C(C)(C)NC(=O)C(CC(C)C)NC(=O)C(C)(C)NC(=O)C(CCC(N)=O)NC(=O)C(C)(C)NC(=O)C(C)(C)NC(=O)C(C)NC(=O)C(CO)NC(=O)C(C)NC(=O)C(C)(C)NC(C)=O)=O)(C)C)=O)CCC1)=O)C(C)C)=O)(C)C)=O)(C)C)=O)CCC(N)=O)=O)CCC(N)=O)=O)CO)C=CC=C2
• InChI: 1S/C91H151N23O25/c1-46(2)40-57(72(128)110-91(24,25)83(139)114-39-29-32-60(114)74(130)105-65(48(5)6)75(131)111-90(22,23)82(138)113-87(16,17)79(135)102-55(34-37-62(93)119)69(125)100-54(33-36-61(92)118)68(124)98-53(44-115)42-52-30-27-26-28-31-52)99-64(121)43-95-76(132)84(10,11)109-73(129)58(41-47(3)4)104-78(134)86(14,15)108-71(127)56(35-38-63(94)120)103-80(136)88(18,19)112-81(137)89(20,21)107-67(123)50(8)96-70(126)59(45-116)101-66(122)49(7)97-77(133)85(12,13)106-51(9)117/h26-28,30-31,46-50,53-60,65,115-116H,29,32-45H2,1-25H3,(H2,92,118)(H2,93,119)(H2,94,120)(H,95,132)(H,96,126)(H,97,133)(H,98,124)(H,99,121)(H,100,125)(H,101,122)(H,102,135)(H,103,136)(H,104,134)(H,105,130)(H,106,117)(H,107,123)(H,108,127)(H,109,129)(H,110,128)(H,111,131)(H,112,137)(H,113,138)
• InChIKey: WFQQTFGAQXPNLX-UHFFFAOYSA-N