CHEBI:32068 - Protorifamycin I

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Protorifamycin I
ChEBI ID CHEBI:32068
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/c1-15-9-8-10-16(2)35(46)36-24-13-25(38)26-23(34(24)45)12-18(4)30(41)27(26)29(40)17(3)11-22(14-37)33(44)21(7)32(43)20(6)31(42)19(5)28(15)39/h8-13,15,19-22,28,31-33,37,39,41-44H,14H2,1-7H3,(H,36,46)/b9-8+,16-10-,17-11+/t15-,19+,20+,21-,22+,28-,31+,32-,33+/m0/s1
InChIKey DWSNNJANRGBGNU-SMGNAMCTSA-N
SMILES C[C@H]1\C=C\C=C(C)/C(=O)NC2=CC(=O)c3c(cc(C)c(O)c3C(=O)\C(C)=C\[C@H](CO)[C@H](O)[C@@H](C)[C@@H](O)[C@H](C)[C@H](O)[C@H](C)[C@H]1O)C2=O
ChEBI Ontology
Outgoing Protorifamycin I (CHEBI:32068) is a azamacrocycle (CHEBI:52898)
Protorifamycin I (CHEBI:32068) is a lactam (CHEBI:24995)
Synonym Source
Protorifamycin I KEGG COMPOUND
Manual Xrefs Databases
C00018209 KNApSAcK
C12246 KEGG COMPOUND
View more database links
Registry Number Type Source
69239-55-0 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014