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Concept information

Preferred term

indocarbazostatin b  

Type

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

Broader concept

charge

  • 0

formula

  • C28H22N4O7

inchi

  • InChI=1S/C28H22N4O7/c1-3-38-26(36)28(37)10-15-31-12-7-5-4-6-11(12)16-19-20(25(35)30-24(19)34)18-17-13(8-9-14(33)21(17)29)32(23(18)22(16)31)27(28,2)39-15/h4-9,15,33,37H,3,10,29H2,1-2H3,(H,30,34,35)/t15-,27+,28-/m1/s1

inchikey

  • VEXMHCAEEISMPG-ZXOINBKBSA-N

mass

  • 526.505

monoisotopicmass

  • 526.14885

smiles

  • O=C1NC(=O)C=2C1=C3C=4N([C@]5(O[C@@H](N6C4C2C7=C6C=CC=C7)C[C@@]5(O)C(=O)OCC)C)C=8C3=C(N)C(O)=CC8

subset

  • 2_STAR

synonym EXACT

  • ethyl (15S,16S,18R)-9-amino-10,16-dihydroxy-15-methyl-3,5-dioxo-28-oxa-4,14,19-triazaoctacyclo[12.11.2.115,18.02,6.07,27.08,13.019,26.020,25]octacosa-1,6,8(13),9,11,20,22,24,26-nonaene-16-carboxylate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:219972

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