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Content language

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

Concept information

Preferred term

اسپیروستان + 2o، 2h، o hex dhex dhex  

Type

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

charge

  • 0

formula

  • C45H72O18

inchi

  • InChI=1S/C45H72O18/c1-17-9-12-45(63-39(17)55)18(2)29-26(62-45)14-25-23-8-7-21-13-22(10-11-43(21,5)24(23)15-28(47)44(25,29)6)58-42-38(61-41-35(53)33(51)31(49)20(4)57-41)36(54)37(27(16-46)59-42)60-40-34(52)32(50)30(48)19(3)56-40/h7,17-20,22-42,46-55H,8-16H2,1-6H3

inchikey

  • MWTJVBOEJQIILT-UHFFFAOYSA-N

mass

  • 901.053

monoisotopicmass

  • 900.47187

smiles

  • O1C2C(C3(C(C4C(CC3O)C5(C(=CC4)CC(OC6OC(C(OC7OC(C(O)C(O)C7O)C)C(O)C6OC8OC(C(O)C(O)C8O)C)CO)CC5)C)C2)C)C(C19OC(O)C(CC9)C)C

subset

  • 2_STAR

synonym EXACT

  • 2-[6-(6',10-dihydroxy-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-yl)oxy-4-hydroxy-2-(hydroxymethyl)-5-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-3-yl]oxy-6-methyloxane-3,4,5-triol

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:184106

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