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Chemistry, part 2

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Concept information

organooxygen compound > polyketide > angucycline > grincamycin i
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > benzenoid aromatic compound > tetraphenes > angucycline > grincamycin i
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic aromatic compound > benzenoid aromatic compound > tetraphenes > angucycline > grincamycin i
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > benzenoid aromatic compound > tetraphenes > angucycline > grincamycin i
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > carbocyclic compound > benzenoid aromatic compound > tetraphenes > angucycline > grincamycin i
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > carbocyclic compound > benzenoid aromatic compound > tetraphenes > angucycline > grincamycin i
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > carbocyclic compound > benzenoid aromatic compound > tetraphenes > angucycline > grincamycin i

Preferred term

grincamycin i  

Type

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

Broader concept

charge

  • 0

formula

  • C49H60O16

inchi

  • InChI=1S/C49H60O16/c1-22-31(50)11-15-38(58-22)62-35-13-17-40(60-24(35)3)64-48-26(5)57-37(19-33(48)52)28-9-10-30-44(45(28)54)47(56)29-8-7-27-20-49(6,21-34(53)42(27)43(29)46(30)55)65-41-18-14-36(25(4)61-41)63-39-16-12-32(51)23(2)59-39/h7-10,22-26,33,35-41,48,52,54H,11-21H2,1-6H3/t22-,23-,24-,25-,26+,33+,35-,36-,37?,38-,39-,40-,41-,48+,49+/m0/s1

inchikey

  • PAUDJWMVHHDYMX-ZYHOXTAXSA-N

mass

  • 905.003

monoisotopicmass

  • 904.38814

smiles

  • O=C1C2=C(O)C(=CC=C2C(=O)C3=C1C=CC4=C3C(=O)C[C@@](O[C@@H]5O[C@H]([C@@H](O[C@@H]6O[C@H](C(=O)CC6)C)CC5)C)(C)C4)C7O[C@@H]([C@@H](O[C@@H]8O[C@H]([C@@H](O[C@@H]9O[C@H](C(=O)CC9)C)CC8)C)[C@@H](C7)O)C

subset

  • 2_STAR

synonym EXACT

  • (3R)-8-hydroxy-9-[(4R,5S,6R)-4-hydroxy-6-methyl-5-[(2S,5S,6S)-6-methyl-5-[(2R,6S)-6-methyl-5-oxooxan-2-yl]oxyoxan-2-yl]oxyoxan-2-yl]-3-methyl-3-[(2S,5S,6S)-6-methyl-5-[(2R,6S)-6-methyl-5-oxooxan-2-yl]oxyoxan-2-yl]oxy-2,4-dihydrobenzo[a]anthracene-1,7,12-trione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:208725

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