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Chemistry, part 2

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > isoprenoid > terpenoid > triterpenoid > hopanoid > bacteriohopane-,32,33,34-triol-35-cyclitolguanine
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > triterpenoid > hopanoid > bacteriohopane-,32,33,34-triol-35-cyclitolguanine

Preferred term

bacteriohopane-,32,33,34-triol-35-cyclitolguanine  

Type

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

Broader concept

charge

  • 0

formula

  • C42H75N3O8

inchi

  • InChI=1S/C42H75N3O8/c1-23(9-10-26(47)32(49)27(48)21-53-35-31(45-36(43)44)33(50)34(51)42(35,52)22-46)24-13-18-38(4)25(24)14-19-40(6)29(38)11-12-30-39(5)17-8-16-37(2,3)28(39)15-20-41(30,40)7/h23-35,46-52H,8-22H2,1-7H3,(H4,43,44,45)/t23-,24?,25?,26?,27?,28?,29?,30?,31?,32?,33?,34?,35?,38-,39-,40+,41+,42?/m0/s1

inchikey

  • HBYLSHNUNMUXCU-VCJINUIQSA-N

mass

  • 750.075

monoisotopicmass

  • 749.55542

smiles

  • OC(CC[C@@H](C1C2[C@@](C3[C@]([C@]4(C([C@@]5(C(CC4)C(CCC5)(C)C)C)CC3)C)(CC2)C)(CC1)C)C)C(O)C(O)COC6C(O)(C(O)C(O)C6N=C(N)N)CO

subset

  • 2_STAR

synonym EXACT

  • 2-[2-[(7S)-7-[(5aR,5bR,11aS,13bS)-5a,5b,8,8,11a,13b-hexamethyl-1,2,3,3a,4,5,6,7,7a,9,10,11,11b,12,13,13a-hexadecahydrocyclopenta[a]chrysen-3-yl]-2,3,4-trihydroxyoctoxy]-3,4,5-trihydroxy-3-(hydroxymethyl)cyclopentyl]guanidine

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:188188

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