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Chemistry, part 1

Content language

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Concept information

... > organooxygen compound > ester > carboxylic ester > lactone > cyclodepsipeptide > actinomycin y5
... > organooxygen compound > carbonyl compound > carboxylic ester > lactone > cyclodepsipeptide > actinomycin y5
organooxygen compound > ester > lactone > cyclodepsipeptide > actinomycin y5
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > carboxamide > peptide > depsipeptide > cyclodepsipeptide > actinomycin y5
... > organooxygen compound > carboxamide > peptide > depsipeptide > cyclodepsipeptide > actinomycin y5
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > peptide > depsipeptide > cyclodepsipeptide > actinomycin y5
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic amino compound > peptide > depsipeptide > cyclodepsipeptide > actinomycin y5
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organic amino compound > peptide > depsipeptide > cyclodepsipeptide > actinomycin y5

Preferred term

actinomycin y5  

Type

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

Broader concept

charge

  • 0

formula

  • C61H80N12O18

inchi

  • InChI=1S/C61H80N12O18/c1-24(2)40-57(84)72-21-32(74)19-34(72)56(83)68(12)22-37(76)70(14)30(10)60(87)90-36-20-62-45-39(53(80)67-44(36)55(82)64-40)46-51(29(9)49(45)78)91-50-27(7)16-17-33(43(50)63-46)52(79)66-42-31(11)89-61(88)47(26(5)6)71(15)38(77)23-69(13)59(86)48-35(75)18-28(8)73(48)58(85)41(25(3)4)65-54(42)81/h16-17,24-26,28,30-31,34-36,40-42,44,47-48,62,75H,18-23H2,1-15H3,(H,64,82)(H,65,81)(H,66,79)(H,67,80)/t28-,30-,31+,34-,35-,36+,40+,41+,42-,44-,47-,48-/m0/s1

inchikey

  • AEIHQKDZICOEDE-JLBKHAGDSA-N

mass

  • 1269.377

monoisotopicmass

  • 1268.57135

smiles

  • O=C1O[C@@H]([C@H](NC(=O)C2=C3N=C4C(=C(C(=O)C5=C4C(=O)N[C@@H]6C(=O)N[C@@H](C(=O)N7[C@H](C(=O)N(C)CC(N([C@H](C(O[C@@H]6CN5)=O)C)C)=O)CC(C7)=O)C(C)C)C)OC3=C(C)C=C2)C(=O)N[C@@H](C(=O)N8[C@@H](C)C[C@@H]([C@H]8C(N(CC(N([C@H]1C(C)C)C)=O)C)=O)O)C(C)C)C

subset

  • 2_STAR

synonym EXACT

  • (1S,20R,23S,29S,35R)-N-[(3R,6S,7R,10S,16S,17S,19S)-17-hydroxy-7,11,14,19-tetramethyl-2,5,9,12,15-pentaoxo-3,10-di(propan-2-yl)-8-oxa-1,4,11,14-tetrazabicyclo[14.3.0]nonadecan-6-yl]-11,15,23,24,27-pentamethyl-3,16,22,25,28,31,34,37-octaoxo-35-propan-2-yl-13,21-dioxa-2,6,18,24,27,33,36-heptazahexacyclo[18.17.0.04,17.05,14.07,12.029,33]heptatriaconta-4(17),5,7,9,11,14-hexaene-8-carboxamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:201977

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