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Chemistry, part 3

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > alkaloid > indole alkaloid > terpenoid indole alkaloid > monoterpenoid indole alkaloid > vinca alkaloid > desacetylvinblastine
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > heteroorganic entity > organonitrogen compound > alkaloid > indole alkaloid > terpenoid indole alkaloid > monoterpenoid indole alkaloid > vinca alkaloid > desacetylvinblastine

Preferred term

desacetylvinblastine  

Type

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

Broader concept

charge

  • 0

formula

  • C44H56N4O8

inchi

  • InChI=1S/C44H56N4O8/c1-7-40(52)22-26-23-43(38(50)55-5,34-28(14-18-47(24-26)25-40)27-12-9-10-13-31(27)45-34)30-20-29-32(21-33(30)54-4)46(3)36-42(29)16-19-48-17-11-15-41(8-2,35(42)48)37(49)44(36,53)39(51)56-6/h9-13,15,20-21,26,35-37,45,49,52-53H,7-8,14,16-19,22-25H2,1-6H3/t26-,35+,36-,37-,40+,41-,42?,43+,44+/m1/s1

inchikey

  • NDMPLJNOPCLANR-SAYSVMKTSA-N

mass

  • 768.952

monoisotopicmass

  • 768.40981

smiles

  • O[C@]1([C@@]2(N(C=3C(C42[C@]5(N(CC4)CC=C[C@]5([C@H]1O)CC)[H])=CC(=C(OC)C3)[C@]6(C[C@]7(C[C@](O)(CN(C7)CCC8=C6NC=9C8=CC=CC9)CC)[H])C(OC)=O)C)[H])C(OC)=O

subset

  • 2_STAR

synonym EXACT

  • methyl (9R,10S,11R,12R,19R)-12-ethyl-4-[(13S,15S,17S)-17-ethyl-17-hydroxy-13-methoxycarbonyl-1,11-diazatetracyclo[13.3.1.04,12.05,10]nonadeca-4(12),5,7,9-tetraen-13-yl]-10,11-dihydroxy-5-methoxy-8-methyl-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6,13-tetraene-10-carboxylate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:172822

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