CHEBI:29668 - Pulvomycin

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Pulvomycin
ChEBI ID CHEBI:29668
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C47H66O13
Net Charge 0
Average Mass 839.021
Monoisotopic Mass 838.45034
InChI InChI=1S/C47H66O13/c1-29-20-19-21-31(3)42(53)38(50)24-17-11-10-12-18-25-40(60-41(52)27-26-30(2)39(51)28-29)33(5)43(54)32(4)36(48)22-15-13-14-16-23-37(49)34(6)58-47-46(57-9)44(55)45(56-8)35(7)59-47/h10-24,26,28,32-35,37-40,43-47,49-51,54-55H,25,27H2,1-9H3/b11-10+,14-13+,18-12+,20-19+,22-15+,23-16+,24-17+,29-28+,30-26-,31-21+/t32?,33?,34?,35-,37?,38?,39?,40?,43?,44+,45+,46-,47-/m1/s1
InChIKey FXSFWUNCIOIMAC-YHQXOMPPSA-N
SMILES CO[C@H]1[C@@H](C)O[C@@H](OC(C)C(O)\C=C\C=C\C=C\C(=O)C(C)C(O)C(C)C2C\C=C\C=C\C=C\C(O)C(=O)\C(C)=C\C=C\C(C)=C\C(O)\C(C)=C/CC(=O)O2)[C@H](OC)[C@H]1O
ChEBI Ontology
Outgoing Pulvomycin (CHEBI:29668) is a macrolide (CHEBI:25106)
Synonym Source
Pulvomycin KEGG COMPOUND
Manual Xrefs Databases
C00018708 KNApSAcK
C12070 KEGG COMPOUND
View more database links
Registry Number Type Source
11006-66-9 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014