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Concept information

Preferred term

هوپترمول A  

Type

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

charge

  • 0

formula

  • C31H40N2O5

inchi

  • InChI=1S/C31H40N2O5/c1-7-21-18-10-16(2)12-30(21,22-8-9-25(35)32-23(22)11-18)33-28-31(37-6)15-24(34)17(3)19-13-29(4,5)14-20(19)26(31)27(36)38-28/h7-10,17-19,24,28,33-34H,11-15H2,1-6H3,(H,32,35)/b21-7+/t17?,18-,19?,24?,28?,30+,31?/m0/s1

inchikey

  • PGQLHDFYYWDJHK-JCQFHHEJSA-N

mass

  • 520.670

monoisotopicmass

  • 520.29372

smiles

  • O=C1NC2=C([C@]3(NC4OC(=O)C=5C4(OC)CC(O)C(C)C6C5CC(C)(C)C6)/C(=C/C)/[C@H](C2)C=C(C3)C)C=C1

subset

  • 2_STAR

synonym EXACT

  • (1R,9R,13E)-13-ethylidene-1-[(5-hydroxy-3a-methoxy-6,8,8-trimethyl-1-oxo-4,5,6,6a,7,9-hexahydro-3H-azuleno[4,5-c]uran-3-yl)amino]-11-methyl-6-azatricyclo[7.3.1.02,7]trideca-2(7),3,10-trien-5-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:205051

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