CHEBI:34349 - 34a-Deoxy-rifamycin W

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 34a-Deoxy-rifamycin W
ChEBI ID CHEBI:34349
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C35H45NO10
Net Charge 0
Average Mass 639.734
Monoisotopic Mass 639.30435
InChI InChI=1S/C35H45NO10/c1-14-10-9-11-15(2)35(46)36-22-13-23(37)24-25(32(43)21(8)33(44)26(24)34(22)45)29(40)17(4)12-16(3)28(39)19(6)31(42)20(7)30(41)18(5)27(14)38/h9-14,16,18-20,27-28,30-31,38-39,41-44H,1-8H3,(H,36,46)/b10-9+,15-11-,17-12+/t14-,16-,18+,19+,20+,27-,28-,30+,31+/m0/s1
InChIKey VFGOUSMZKMNRLA-CVQHHNHTSA-N
SMILES C[C@H]1\C=C\C=C(C)/C(=O)NC2=CC(=O)c3c(C2=O)c(O)c(C)c(O)c3C(=O)\C(C)=C\[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@H](C)[C@H](O)[C@H](C)[C@H]1O
ChEBI Ontology
Outgoing 34a-Deoxy-rifamycin W (CHEBI:34349) is a azamacrocycle (CHEBI:52898)
34a-Deoxy-rifamycin W (CHEBI:34349) is a lactam (CHEBI:24995)
Synonym Source
34a-Deoxy-rifamycin W KEGG COMPOUND
Manual Xrefs Databases
C00015234 KNApSAcK
C14721 KEGG COMPOUND
View more database links
Registry Number Type Source
442871-33-2 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014