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Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

Preferred term

glucoconvallatoxoloside  

Type

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

Broader concept

charge

  • 0

formula

  • C41H64O20

inchi

  • InChI=1S/C41H64O20/c1-17-33(60-37-32(52)29(49)34(24(14-43)59-37)61-36-30(50)27(47)26(46)23(13-42)58-36)28(48)31(51)35(56-17)57-19-3-8-39(16-44)21-4-7-38(2)20(18-11-25(45)55-15-18)6-10-41(38,54)22(21)5-9-40(39,53)12-19/h11,17,19-24,26-37,42-44,46-54H,3-10,12-16H2,1-2H3

inchikey

  • MJMGVGSJSVKKJC-UHFFFAOYSA-N

mass

  • 876.943

monoisotopicmass

  • 876.39909

smiles

  • OC12C3C(C4(C(O)(CC3)CC(OC5OC(C(OC6OC(C(OC7OC(C(O)C(O)C7O)CO)C(O)C6O)CO)C(O)C5O)C)CC4)CO)CCC1(C(CC2)C=8COC(=O)C8)C

subset

  • 2_STAR

synonym EXACT

  • 3-[3-[5-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxy-6-methyloxan-2-yl]oxy-5,14-dihydroxy-10-(hydroxymethyl)-13-methyl-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2H-uran-5-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:189935

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