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Concept information

Preferred term

leptosin g1  

Type

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

Broader concept

charge

  • 0

formula

  • C32H32N6O7S6

inchi

  • InChI=1S/C32H32N6O7S6/c1-14(2)30-26(45)38-22-29(16-10-6-8-12-18(16)34-22,20(41)32(38,49-51-47-30)25(44)36(30)4)28-15-9-5-7-11-17(15)33-21(28)37-23(42)27(13-39)35(3)24(43)31(37,19(28)40)48-50-46-27/h5-12,14,19-22,33-34,39-41H,13H2,1-4H3/t19-,20-,21-,22+,27-,28-,29?,30-,31-,32-/m0/s1

inchikey

  • FNGREQNWOPPQJI-HGTYPDCTSA-N

mass

  • 805.000

monoisotopicmass

  • 804.06567

smiles

  • S1S[C@@]2(N(C)C([C@]3(S1)N([C@H]4NC=5C=CC=CC5C4([C@@H]3O)[C@]67C8=C(C=CC=C8)N[C@H]6N9C(=O)[C@@]%10(SSS[C@@]9([C@H]7O)C(=O)N%10C)CO)C2=O)=O)C(C)C

subset

  • 2_STAR

synonym EXACT

  • (1S,2S,3R,11S,14S)-2-hydroxy-14-(hydroxymethyl)-3-[(1S,2S,3S,11R,14S)-2-hydroxy-19-methyl-13,18-dioxo-14-propan-2-yl-15,16,17-trithia-10,12,19-triazapentacyclo[12.3.2.01,12.03,11.04,9]nonadeca-4,6,8-trien-3-yl]-19-methyl-15,16,17-trithia-10,12,19-triazapentacyclo[12.3.2.01,12.03,11.04,9]nonadeca-4,6,8-triene-13,18-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:215725

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