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Concept information

Preferred term

25-hydroxyfumitremorgin a  

Type

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

Broader concept

charge

  • 0

formula

  • C32H41N3O8

inchi

  • InChI=1S/C32H41N3O8/c1-18(2)11-13-41-28-26-21-10-9-20(40-6)15-23(21)34-25(14-19(3)17-36)42-43-31(4,5)16-24(27(26)34)35-29(37)22-8-7-12-33(22)30(38)32(28,35)39/h9-11,14-15,22,24-25,28,36,39H,7-8,12-13,16-17H2,1-6H3/t22-,24-,25+,28-,32+/m0/s1

inchikey

  • MROXPMGDKBAOJZ-BMOJZYMJSA-N

mass

  • 595.693

monoisotopicmass

  • 595.28937

smiles

  • O=C1N2[C@H](C(=O)N3[C@@]1(O)[C@@H](OCC=C(C)C)C=4C5=C(C=C(OC)C=C5)N6C4[C@@H]3CC(OO[C@@H]6C=C(CO)C)(C)C)CCC2

subset

  • 2_STAR

synonym EXACT

  • (9R,14S,17S,23R,24S)-23-hydroxy-9-(3-hydroxy-2-methylprop-1-enyl)-5-methoxy-12,12-dimethyl-24-(3-methylbut-2-enoxy)-10,11-dioxa-8,15,21-triazahexacyclo[12.10.1.02,7.08,25.015,23.017,21]pentacosa-1(25),2(7),3,5-tetraene-16,22-dione

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:210704

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