skip to main content

Content language

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

Concept information

Preferred term

روبرولون بی  

Type

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

charge

  • 0

formula

  • C30H27NO10

inchi

  • InChI=1S/C30H27NO10/c1-4-7-18-21-15(10-12(2)31(18)17-9-6-5-8-14(17)28(37)38)20-16(24(21)34)11-19(32)22-26(25(20)35)41-29-30(22,39)27(36)23(33)13(3)40-29/h5-6,8-11,13,23,27,29,33,36,39H,4,7H2,1-3H3,(H,37,38)/t13-,23+,27+,29+,30-/m1/s1

inchikey

  • PTMNVLNJDQOZSM-NHSNCPHISA-N

mass

  • 561.543

monoisotopicmass

  • 561.16350

smiles

  • O=C1C=2O[C@@H]3O[C@H](C)[C@@H]([C@@H]([C@@]3(C2C(=O)C=C4C1=C5C(=C(N(C6=C(C(=O)O)C=CC=C6)C(=C5)C)CCC)C4=O)O)O)O

subset

  • 2_STAR

synonym EXACT

  • 2-[(15R,16S,17R,18R,20S)-15,16,17-trihydroxy-6,18-dimethyl-2,10,13-trioxo-8-propyl-19,21-dioxa-7-azapentacyclo[12.7.0.03,11.04,9.015,20]henicosa-1(14),3,5,8,11-pentaen-7-yl]benzoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:216231

Download this concept: