CAS 58814-86-1: N-{(2S,3S,3aR,6R,7R,12S,16R,17aS,20S,23S)-20-[(1S,2S)-1,2-dihydroxy-3-(4-hydroxyphenyl)propyl]-3,6,7,16-tetrahydroxy-12,23-bis[(1R)-1-hydroxyethyl]-2-methyl-10,13,18,21,24-pentaoxodocosahydro-5H,15H-dipyrrolo[1,2-k:1',2'-t][1,2,8,11,14,17,20]oxahexaazacyc

Formula:C₅₁H₈₅N₇O₁₆

InChI:InChI=1S/C50H81N7O16/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-36(63)51-33-24-35(62)46(69)55-48(71)40-41(64)27(2)25-57(40)50(73)38(29(4)59)53-47(70)39(43(66)42(65)30-19-21-31(60)22-20-30)54-45(68)34-23-32(61)26-56(34)49(72)37(28(3)58)52-44(33)67/h19-22,27-29,32-35,37-43,46,58-62,64-66,69H,5-18,23-26H2,1-4H3,(H,51,63)(H,52,67)(H,53,70)(H,54,68)(H,55,71)

InChI key:InChIKey=YKPHLXGEPNYRPY-UHFFFAOYSA-N

SMILES:O=C(NC1C(=O)NC(C(=O)N2CC(O)CC2C(=O)NC(C(=O)NC(C(=O)N3CC(C)C(O)C3C(=O)NC(O)C(O)C1)C(O)C)C(O)C(O)C4=CC=C(O)C=C4)C(O)C)CCCCCCCCCCCCCCC