2-[6-ethyl-2-hydroxy-5-(2-hydroxy-2-methyl-butanoyl)tetrahydropyran-2-yl]-n-[ethyl-trihydroxy-[5-(5-hydroxy-4-methoxy-6-methyl-tetrahydropyran-2-yl)oxy-4-methoxy-6-methyl-tetrahydropyran-2-yl]oxy-isopropyl-(methoxymethyl)-hexaoxo-[?]yl]-2-hydroxy-propanamide

Structural Information

Molecular Formula

C₅₈H₉₄N₈O₂₄

SMILES

CC[C@H]1C(=O)O[C@H]([C@@H](C(=O)N2[C@H](CCCN2)C(=O)N([C@H](C(=O)N3C(C=C(CN3)OC4CC(C(C(O4)C)OC5CC(C(C(O5)C)O)OC)OC)C(=O)N6CC[C@H]([C@H]6C(=O)N1O)O)COC)O)NC(=O)C(C)(C7(CCC(C(O7)CC)C(=O)C(C)(CC)O)O)O)C(C)C

InChI

InChI=1S/C58H94N8O24/c1-13-33-54(75)89-46(28(4)5)43(61-55(76)57(9,78)58(79)20-18-32(38(14-2)90-58)48(69)56(8,77)15-3)52(73)63-34(17-16-21-59-63)51(72)66(81)36(27-82-10)50(71)64-35(49(70)62-22-19-37(67)44(62)53(74)65(33)80)23-31(26-60-64)87-41-25-40(84-12)47(30(7)86-41)88-42-24-39(83-11)45(68)29(6)85-42/h23,28-30,32-47,59-60,67-68,77-81H,13-22,24-27H2,1-12H3,(H,61,76)/t29?,30?,32?,33-,34+,35?,36-,37+,38?,39?,40?,41?,42?,43-,44-,45?,46-,47?,56?,57?,58?/m0/s1

InChIKey

ZAZMSTXZLMFARG-DTXDFCKTSA-N

Compound name

2-[6-ethyl-2-hydroxy-5-(2-hydroxy-2-methylbutanoyl)oxan-2-yl]-N-[(6R,7S,10S,13S,14S,21R,24S)-10-ethyl-6,9,23-trihydroxy-29-[5-(5-hydroxy-4-methoxy-6-methyloxan-2-yl)oxy-4-methoxy-6-methyloxan-2-yl]oxy-24-(methoxymethyl)-2,8,11,15,22,25-hexaoxo-13-propan-2-yl-12-oxa-3,9,16,17,23,26,27-heptazatetracyclo[24.4.0.03,7.016,21]triacont-29-en-14-yl]-2-hydroxypropanamide

Related CIDs

• CID 86580246