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CHEBI:231461 - polytolypin(2−)

Default Structure
ChEBI IDCHEBI:231461
ChEBI Namepolytolypin(2−)
Stars
ASCII Namepolytolypin(2-)
DefinitionMajor microspecies at pH 7.3.
SubmitterAnne Morgat
DownloadsMolfile
FormulaC30H44O7
Net Charge-2
Average Mass516.675
Monoisotopic Mass516.30980
SMILES[H][C@@]12CC[C@H](C(C)C)[C@@]1(C)CC[C@]1(C)C3=CC[C@]4([H])[C@](C(=O)[O-])([C@H](O)[C@@H](O)[C@H](O)[C@@]4(C)C(=O)[O-])[C@@]3([H])CC[C@@]21C
InChIInChI=1S/C30H46O7/c1-15(2)16-7-9-19-26(16,3)13-14-27(4)17-8-10-20-29(6,24(34)35)22(32)21(31)23(33)30(20,25(36)37)18(17)11-12-28(19,27)5/h8,15-16,18-23,31-33H,7,9-14H2,1-6H3,(H,34,35)(H,36,37)/p-2/t16-,18+,19-,20+,21+,22+,23-,26-,27-,28+,29+,30+/m1/s1
InChIKeyXQTYVRJXBNIGML-WCANRZOWSA-L
ChEBI Ontology
Outgoing Relation(s)
polytolypin(2−) (CHEBI:231461) is a triterpenoid (CHEBI:36615)
polytolypin(2−) (CHEBI:231461) is conjugate base of Polytolypin (CHEBI:198073)
Incoming Relation(s)
Polytolypin (CHEBI:198073) is conjugate acid of polytolypin(2−) (CHEBI:231461)
UniProt Name  Source
polytolypinUniProt
Citations