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Concept information

Preferred term

jadomycin s  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C27H25NO10

inchi

  • InChI=1S/C27H25NO10/c1-10-6-13-19(15(30)7-10)21-22(28-14(9-29)27(35)38-26(13)28)25(34)20-12(24(21)33)4-3-5-17(20)37-18-8-16(31)23(32)11(2)36-18/h3-7,11,14,16,18,23,26,29-32H,8-9H2,1-2H3/t11-,14-,16+,18-,23-,26-/m0/s1

inchikey

  • YJZPHITXTBWGEN-KMYSFCLLSA-N

mass

  • 523.494

monoisotopicmass

  • 523.14785

smiles

  • O=C1C=2N3[C@@H](OC([C@@H]3CO)=O)C=4C=C(C)C=C(C4C2C(=O)C=5C1=C(O[C@@H]6O[C@H]([C@H](O)[C@@H](C6)O)C)C=CC5)O

subset

  • 2_STAR

synonym EXACT

  • (3S,6S)-19-[(2S,4R,5R,6S)-4,5-dihydroxy-6-methyloxan-2-yl]oxy-11-hydroxy-3-(hydroxymethyl)-9-methyl-5-oxa-2-azapentacyclo[11.8.0.02,6.07,12.015,20]henicosa-1(13),7(12),8,10,15(20),16,18-heptaene-4,14,21-trione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:202869

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