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Concept information

Preferred term

گانولوکین D  

Type

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

Broader concept

charge

  • 0

formula

  • C32H44O9

inchi

  • InChI=1S/C32H44O9/c1-16(9-8-10-17(2)28(39)40)19-13-23(37)32(7)24-20(35)14-21-29(4,12-11-22(36)30(21,5)15-33)25(24)26(38)27(31(19,32)6)41-18(3)34/h10,16,19-21,27,33,35H,8-9,11-15H2,1-7H3,(H,39,40)/b17-10+/t16-,19-,20+,21-,27+,29+,30+,31+,32+/m1/s1

inchikey

  • HOPDNBIFYDWRMF-YULVEHMRSA-N

mass

  • 572.695

monoisotopicmass

  • 572.29853

smiles

  • O=C1C2=C([C@@]3(C(=O)C[C@@H]([C@]3([C@H]1OC(=O)C)C)[C@@H](CC/C=C(/C(=O)O)/C)C)C)[C@@H](O)C[C@@H]4[C@@]2(CCC([C@]4(CO)C)=O)C

subset

  • 2_STAR

synonym EXACT

  • (E,6R)-6-[(4R,5R,7S,10S,12R,13R,14R,17R)-12-acetyloxy-7-hydroxy-4-(hydroxymethyl)-4,10,13,14-tetramethyl-3,11,15-trioxo-1,2,5,6,7,12,16,17-octahydrocyclopenta[a]phenanthren-17-yl]-2-methylhept-2-enoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:206775

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