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Concept information

Preferred term

Blazeispirol V1  

Type

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

charge

  • 0

formula

  • C28H38O6

inchi

  • InChI=1S/C28H38O6/c1-14-17-9-12-27(34-28(14)23(32)15(2)24(3,4)33-28)20-18(8-11-26(17,27)6)25(5)10-7-16(29)13-19(25)21(30)22(20)31/h8,11,13-15,17,21-23,30-32H,7,9-10,12H2,1-6H3/t14-,15-,17+,21-,22-,23+,25+,26+,27-,28-/m0/s1

inchikey

  • GKTIPUYIQKAQLI-LTGVEDDOSA-N

mass

  • 470.606

monoisotopicmass

  • 470.26684

smiles

  • O=C1C=C2[C@](C3=C([C@]45O[C@@]6(OC(C)(C)[C@H]([C@H]6O)C)[C@@H](C)[C@H]([C@@]4(C)C=C3)CC5)[C@@H]([C@H]2O)O)(C)CC1

subset

  • 2_STAR

synonym EXACT

  • (1R,3S,3'R,4S,4'S,10R,14R,15R,16S,17S)-3,3',4-trihydroxy-4',5',5',10,14,16-hexamethylspiro[18-oxapentacyclo[13.3.2.01,14.02,11.05,10]icosa-2(11),5,12-triene-17,2'-oxolane]-7-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:213638

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