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CHEBI:231479 - (1S)-1,7-diacetoxy-luvungin A

ChEBI IDCHEBI:231479
ChEBI Name(1S)-1,7-diacetoxy-luvungin A
Stars
ASCII Name(1S)-1,7-diacetoxy-luvungin A
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC36H52O10
Net Charge0
Average Mass644.802
Monoisotopic Mass644.35605
SMILES[H][C@]12CC[C@]3(C)C(=CC[C@@]3([H])[C@@H]3C[C@H]([C@@H]4OC4(C)C)O[C@H]3OC(C)=O)[C@]1(C)[C@H](OC(C)=O)C[C@@]1([H])C(C)(C)OC(=O)C[C@H](OC(C)=O)[C@]21C
InChIInChI=1S/C36H52O10/c1-18(37)41-27-16-26-32(4,5)45-29(40)17-28(42-19(2)38)36(26,10)25-13-14-34(8)22(11-12-24(34)35(25,27)9)21-15-23(30-33(6,7)46-30)44-31(21)43-20(3)39/h12,21-23,25-28,30-31H,11,13-17H2,1-10H3/t21-,22-,23+,25-,26-,27+,28-,30-,31+,34-,35-,36+/m0/s1
InChIKeyAVVJHONDHCEGRL-PWLMGTSTSA-N
ChEBI Ontology
Outgoing Relation(s)
(1S)-1,7-diacetoxy-luvungin A (CHEBI:231479) is a acetate ester (CHEBI:47622)
(1S)-1,7-diacetoxy-luvungin A (CHEBI:231479) is a epoxide (CHEBI:32955)
(1S)-1,7-diacetoxy-luvungin A (CHEBI:231479) is a organic heterohexacyclic compound (CHEBI:51914)
UniProt Name  Source
(1S)-1,7-diacetoxy-luvungin AUniProt
Citations