Chebi:195210

Structural Information

Molecular Formula

C₃₄H₅₄N₆O₁₉

SMILES

C[C@@H](C(=O)N[C@H](CCC(=O)N[C@@H](CCC[C@H](C(=O)O)N)C(=O)O)C(=O)O)NC(=O)[C@@H](C)O[C@@H]1[C@H]([C@@H]2OC[C@H]([C@H]1O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)NC(=O)C)O2)NC(=O)C

InChI

InChI=1S/C34H54N6O19/c1-12(28(47)40-18(32(53)54)8-9-21(44)39-17(31(51)52)7-5-6-16(35)30(49)50)36-29(48)13(2)56-27-23(38-15(4)43)33-55-11-20(58-33)26(27)59-34-22(37-14(3)42)25(46)24(45)19(10-41)57-34/h12-13,16-20,22-27,33-34,41,45-46H,5-11,35H2,1-4H3,(H,36,48)(H,37,42)(H,38,43)(H,39,44)(H,40,47)(H,49,50)(H,51,52)(H,53,54)/t12-,13+,16+,17-,18+,19+,20+,22+,23+,24+,25+,26+,27+,33+,34-/m0/s1

InChIKey

DOEJFZOCNOYIFL-SLVNCHPGSA-N

Compound name

(2S,6R)-2-[[(4R)-4-[[(2S)-2-[[(2R)-2-[[(1R,2S,3R,4R,5R)-4-acetamido-2-[(2S,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6,8-dioxabicyclo[3.2.1]octan-3-yl]oxy]propanoyl]amino]propanoyl]amino]-4-carboxybutanoyl]amino]-6-aminoheptanedioic acid

Related CIDs

• CID 168266065