CHEBI:203073 - MK800-62F1

ChEBI IDCHEBI:203073
ChEBI NameMK800-62F1
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC35H58O8
Net Charge0
Average Mass606.841
Monoisotopic Mass606.41317
SMILESCC1(C)C[C@H]2C3=CCC4[C@@]5(C)CC[C@H](O)[C@](C)(CO)C5CC[C@@]4(C)[C@]3(C)CC[C@@]2(C)[C@H](O[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O)[C@@H]1O
InChIInChI=1S/C35H58O8/c1-30(2)16-20-19-8-9-23-32(4)12-11-24(38)33(5,18-36)22(32)10-13-35(23,7)34(19,6)15-14-31(20,3)28(27(30)41)43-29-26(40)25(39)21(37)17-42-29/h8,20-29,36-41H,9-18H2,1-7H3/t20-,21-,22?,23?,24-,25-,26+,27-,28+,29-,31+,32-,33+,34+,35+/m0/s1
InChIKeyHRCPDUWVAPWYLU-IOMUPYOPSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (10966071)
ChEBI Ontology
Outgoing Relation(s)
MK800-62F1 (CHEBI:203073) is a triterpenoid (CHEBI:36615)
IUPAC Name 
(2S,3R,4S,5S)-2-[[(3R,4S,4aR,6aS,6bR,9S,10S,12aR,14bS)-3,10-dihydroxy-9-(hydroxymethyl)-2,2,4a,6a,6b,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicen-4-yl]oxy]oxane-3,4,5-triol
Manual XrefsDatabases
8897729ChemSpider