Term: | Sarpeptin B |
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Accession: | CHEBI:224541
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Synonyms: | exact_synonym: | (3R)-4-amino-3-[[(2R)-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-3-carboxy-3-hydroxy-2-[[2-[[2-[[(2E,4Z)-8-methyldeca-2,4-dienoyl]amino]acetyl]amino]acetyl]amino]propanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-hydroxybutanoyl]amino]-4-methylpentanoyl]amino]-2-hydroxy-4-oxobutanoic acid |
| related_synonym: | Formula=C42H62N8O16; InChI=1S/C42H62N8O16/c1-6-22(4)11-9-7-8-10-12-28(53)44-19-29(54)45-20-30(55)48-33(35(57)42(65)66)40(62)47-27(18-24-13-15-25(52)16-14-24)38(60)49-31(23(5)51)39(61)46-26(17-21(2)3)37(59)50-32(36(43)58)34(56)41(63)64/h7-8,10,12-16,21-23,26-27,31-35,51-52,56-57H,6,9,11,17-20H2,1-5H3,(H2,43,58)(H,44,53)(H,45,54)(H,46,61)(H,47,62)(H,48,55)(H,49,60)(H,50,59)(H,63,64)(H,65,66)/b8-7-,12-10+/t22?,23-,26-,27+,31+,32-,33+,34?,35?/m1/s1; InChIKey=FZUDENSOWQNVBO-BRWUTIDASA-N; SMILES=O=C(NCC(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@@H](C(=O)N)C(O)C(=O)O)CC(C)C)[C@H](O)C)CC1=CC=C(O)C=C1)C(O)C(=O)O)/C=C/C=C\\CCC(CC)C |
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