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Concept information

Preferred term

penochalasin e  

Type

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

Broader concept

charge

  • 0

formula

  • C32H38N2O5

inchi

  • InChI=1S/C32H38N2O5/c1-17-8-7-10-22-29-31(4,39-29)19(3)27-24(15-20-16-33-23-11-6-5-9-21(20)23)34-30(38)32(22,27)26(36)13-12-25(35)28(37)18(2)14-17/h5-7,9-11,14,16-17,19,22,24,27-29,33,37H,8,12-13,15H2,1-4H3,(H,34,38)/b10-7-,18-14-/t17-,19-,22-,24?,27-,28-,29-,31+,32-/m0/s1

inchikey

  • NHUOPFQUMNXHQK-AZHONJPQSA-N

mass

  • 530.665

monoisotopicmass

  • 530.27807

smiles

  • O=C1[C@]23C(=O)NC([C@@H]2[C@H](C)[C@@]4([C@H]([C@@H]3C=CC[C@H](C)C=C([C@@H](C(CC1)=O)O)C)O4)C)CC=5C6=C(C=CC=C6)NC5

subset

  • 2_STAR

synonym EXACT

  • (1S,6S,7Z,9S,11Z,13R,14S,16R,17S,18R)-6-hydroxy-19-(1H-indol-3-ylmethyl)-7,9,16,17-tetramethyl-15-oxa-20-azatetracyclo[11.8.0.01,18.014,16]henicosa-7,11-diene-2,5,21-trione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:216356

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