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Chemistry, part 3

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > oxygen molecular entity > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > glycosyl compound > glycoside > aminoglycoside > 28-deoxystambomycin a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > glycosyl compound > glycoside > aminoglycoside > 28-deoxystambomycin a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > heteroorganic entity > organochalcogen compound > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > glycosyl compound > glycoside > aminoglycoside > 28-deoxystambomycin a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > oxygen molecular entity > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > aminoglycoside > 28-deoxystambomycin a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > aminoglycoside > 28-deoxystambomycin a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > heteroorganic entity > organochalcogen compound > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > aminoglycoside > 28-deoxystambomycin a

Preferred term

28-deoxystambomycin a  

Type

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

Broader concept

charge

  • 0

formula

  • C73H133NO21

inchi

  • InChI=1S/C73H133NO21/c1-14-42(2)21-17-23-52-35-45(5)64(86)38-55(77)26-19-29-59(81)47(7)58(80)27-16-15-22-44(4)69(88)49(9)65-40-66(94-72-71(90)68(74(12)13)70(89)51(11)93-72)50(10)73(91,95-65)41-67(87)92-46(6)32-33-56(78)36-53(75)24-18-28-60(82)48(8)61(83)34-31-43(3)63(85)39-57(79)37-54(76)25-20-30-62(52)84/h15-16,22,32-33,35,42-43,46-66,68-72,75-86,88-91H,14,17-21,23-31,34,36-41H2,1-13H3/b16-15-,33-32-,44-22-,45-35-/t42?,43?,46?,47?,48?,49?,50?,51-,52?,53?,54?,55?,56?,57?,58?,59?,60?,61?,62?,63?,64?,65?,66?,68+,69?,70-,71-,72+,73?/m1/s1

inchikey

  • UEYLSFDKSXZPKX-CAWZTLBBSA-N

mass

  • 1360.853

monoisotopicmass

  • 1359.93701

smiles

  • O=C1OC(C=CC(O)CC(O)CCCC(O)C(C(O)CCC(C(O)CC(O)CC(O)CCCC(C(C=C(C(CC(CCCC(C(C(CC=CC=C(C(C(C2OC(C1)(O)C(C(O[C@@H]3O[C@@H]([C@@H](O)[C@@H]([C@H]3O)N(C)C)C)C2)C)C)O)C)O)C)O)O)O)C)CCCC(CC)C)O)C)C)C

subset

  • 2_STAR

synonym EXACT

  • (6E,30E,42E,44E)-50-[(2R,3R,4S,5S,6R)-4-(dimethylamino)-3,5-dihydroxy-6-methyloxan-2-yl]oxy-1,8,10,14,16,20,22,24,28,32,34,38,40,46-tetradecahydroxy-5,15,19,31,39,45,47,51-octamethyl-29-(4-methylhexyl)-4,52-dioxabicyclo[46.3.1]dopentaconta-6,30,42,44-tetraen-3-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:220284

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