CHEBI:142728 - rifamycin SV para-naphthoquinone carboxamide(2−)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name rifamycin SV para-naphthoquinone carboxamide(2−)
ChEBI ID CHEBI:142728
ChEBI ASCII Name rifamycin SV para-naphthoquinone carboxamide(2-)
Definition Major species at pH 7.3.
Stars This entity has been manually annotated by a third party.
Submitter Anne Morgat
Supplier Information
Download Molfile XML SDF
Formula C37H45NO13
Net Charge -2
Average Mass 711.754
Monoisotopic Mass 711.29019
InChI InChI=1S/C37H47NO13/c1-16(11-10-12-17(2)36(38)47)29(42)19(4)30(43)20(5)33(50-22(7)39)18(3)25(48-9)13-14-49-37(8)35(46)28-26-23(40)15-24(41)32(45)27(26)31(44)21(6)34(28)51-37/h10-16,18-20,25,29-30,33,41-44H,1-9H3,(H2,38,47)/p-2/b11-10+,14-13+,17-12-/t16-,18+,19+,20+,25-,29-,30+,33+,37-/m0/s1
InChIKey IGTXWELEYCMXQP-ODRIEIDWSA-L
SMILES [C@H](C)([C@@H]([C@@H]([C@H](\C=C\O[C@]1(OC=2C(C1=O)=C3C(C(C(=CC3=O)[O-])=O)=C(C2C)[O-])C)OC)C)OC(=O)C)[C@H](O)[C@@H]([C@@H](O)[C@@H](C)/C=C/C=C(/C)\C(N)=O)C
ChEBI Ontology
Outgoing rifamycin SV para-naphthoquinone carboxamide(2−) (CHEBI:142728) has functional parent rifamycin SV(1−) (CHEBI:84571)
rifamycin SV para-naphthoquinone carboxamide(2−) (CHEBI:142728) is a hydroxynaphthoquinone (CHEBI:132155)
Synonym Source
rifamycin SV para-naphthoquinone carboxamide UniProt
Citation Waiting for Citations Type Source
29398560 PubMed citation SUBMITTER