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Concept information

Preferred term

bullatacinone  

Type

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

Broader concept

charge

  • 0

formula

  • C37H66O7

inchi

  • InChI=1S/C37H66O7/c1-3-4-5-6-7-11-14-17-20-31(39)33-22-24-35(43-33)36-25-23-34(44-36)32(40)21-18-15-12-9-8-10-13-16-19-30-27-29(26-28(2)38)37(41)42-30/h29-36,39-40H,3-27H2,1-2H3/t29-,30-,31+,32-,33-,34-,35-,36-/m1/s1

inchikey

  • KGGVWMAPBXIMEM-ZRTAFWODSA-N

mass

  • 622.917

monoisotopicmass

  • 622.48085

smiles

  • CCCCCCCCCC[C@H](O)[C@H]1CCC(O1)[C@H]1CC[C@@H](O1)[C@H](O)CCCCCCCCCC[C@@H]1C[C@@H](CC(C)=O)C(=O)O1

subset

  • 2_STAR

synonym EXACT

  • Bullatacinone

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:3212

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