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Concept information

ترکیب اکسیژن ارگانیک > استر > لاکتون > سیکلودپسی پپتید > [b MePro] دستروکسین E کلروهیدرین

Preferred term

[b MePro] دستروکسین E کلروهیدرین  

Type

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

charge

  • 0

formula

  • C30H50ClN5O8

inchi

  • InChI=1S/C30H50ClN5O8/c1-9-17(4)23-29(42)35(8)24(16(2)3)30(43)34(7)19(6)26(39)32-12-10-22(38)44-21(14-20(37)15-31)28(41)36-13-11-18(5)25(36)27(40)33-23/h16-21,23-25,37H,9-15H2,1-8H3,(H,32,39)(H,33,40)/t17?,18-,19-,20-,21?,23-,24-,25-/m0/s1

inchikey

  • QWYNOTGFLNERCP-IRDIRMKXSA-N

mass

  • 644.210

monoisotopicmass

  • 643.33479

smiles

  • ClC[C@@H](O)CC1OC(=O)CCNC(=O)[C@@H](N(C(=O)[C@@H](N(C([C@@H](NC([C@H]2N(C1=O)CC[C@@H]2C)=O)C(CC)C)=O)C)C(C)C)C)C

subset

  • 2_STAR

synonym EXACT

  • (10S,13S,16S,19S,20S)-16-butan-2-yl-3-[(2S)-3-chloro-2-hydroxypropyl]-10,11,14,20-tetramethyl-13-propan-2-yl-4-oxa-1,8,11,14,17-pentazabicyclo[17.3.0]docosane-2,5,9,12,15,18-hexone

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:212766

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