Terminology Service for NFDI4Health
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Gomphrenin-V

Go to external page http://purl.obolibrary.org/obo/CHEBI_5519

Term info

Label

Gomphrenin-V

Synonyms
  • Gomphrenin-V
database cross reference
Subsets

2_STAR

charge

0

formula

C34H34N2O16

has obo namespace

chebi_ontology

id

CHEBI:5519

inchi

InChI=1S/C34H34N2O16/c1-49-24-10-15(2-4-22(24)37)3-5-27(39)50-14-26-28(40)29(41)30(42)34(52-26)51-25-13-20-17(12-23(25)38)11-21(33(47)48)36(20)7-6-16-8-18(31(43)44)35-19(9-16)32(45)46/h2-8,10,12-13,19,21,26,28-30,34,40-42H,9,11,14H2,1H3,(H5,37,38,39,43,44,45,46,47,48)/t19-,21-,26+,28+,29-,30+,34+/m0/s1

inchikey

PZVSGHKONASTEC-WPUGSIMNSA-N

mass

726.639

monoisotopicmass

726.19083

smiles

COc1cc(\C=C\C(=O)OC[C@H]2O[C@@H](Oc3cc4c(C[C@@H](C([O-])=O)\[N+]4=C/C=C4C[C@H](NC(=C\4)C(O)=O)C(O)=O)cc3O)[C@H](O)[C@@H](O)[C@@H]2O)ccc1O