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

Concept information

Preferred term

resinacein s  

Type

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

Broader concept

charge

  • 0

formula

  • C30H44O7

inchi

  • InChI=1S/C30H44O7/c1-15(12-19(31)25(35)16(2)26(36)37)18-13-23(34)30(7)17-8-9-21-27(3,4)22(33)10-11-28(21,5)24(17)20(32)14-29(18,30)6/h15-16,18,21-22,25,33,35H,8-14H2,1-7H3,(H,36,37)/t15-,16?,18-,21?,22+,25?,28+,29-,30-/m1/s1

inchikey

  • FMNZGPOZCOZLMN-TVPRLHGPSA-N

mass

  • 516.675

monoisotopicmass

  • 516.30870

smiles

  • O=C1C2=C([C@@]3(C(=O)C[C@@H]([C@]3(C1)C)[C@@H](CC(=O)C(O)C(C(=O)O)C)C)C)CCC4[C@@]2(CC[C@@H](C4(C)C)O)C

subset

  • 2_STAR

synonym EXACT

  • (6R)-3-hydroxy-6-[(3S,10S,13R,14R,17R)-3-hydroxy-4,4,10,13,14-pentamethyl-11,15-dioxo-2,3,5,6,7,12,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methyl-4-oxoheptanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:215610

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