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Concept information

Preferred term

گانوکولوبتاوزین D  

Type

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

Broader concept

charge

  • 0

formula

  • C34H48O8

inchi

  • InChI=1S/C34H48O8/c1-20(30(38)39)9-11-27(41-22(3)35)21(2)24-13-16-33(8)25-10-12-28(31(5,6)42-23(4)36)34(18-15-29(37)40-19-34)26(25)14-17-32(24,33)7/h9-10,14,21,24,27-28H,11-13,15-19H2,1-8H3,(H,38,39)/t21-,24+,27-,28-,32+,33-,34-/m0/s1

inchikey

  • OEPQDGZQGVNYOZ-LTOGEVMSSA-N

mass

  • 584.750

monoisotopicmass

  • 584.33492

smiles

  • O=C1OC[C@]2(C=3C(=CC[C@H]2C(OC(=O)C)(C)C)[C@]4([C@]([C@@H]([C@@H]([C@@H](OC(=O)C)CC=C(C(=O)O)C)C)CC4)(C)CC3)C)CC1

subset

  • 2_STAR

synonym EXACT

  • (5S,6S)-6-[(3R,3aR,6R,7R,9bR)-7-(2-acetyloxypropan-2-yl)-3a,9b-dimethyl-2'-oxospiro[1,2,3,4,7,8-hexahydrocyclopenta[a]naphthalene-6,5'-oxane]-3-yl]-5-acetyloxy-2-methylhept-2-enoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:226753

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