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klymollin G

PropertiesImageOccurences in reactions
MNX_IDMNXM105975Image of MNXM105975
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC42H70O11
charge0
mass750.49181
referencechebi:68957
InChIKeyCRUQATXTOIHPSF-FCGGQWSASA-N
InChIInChI=1S/C42H70O11/c1-9-10-11-12-13-14-15-16-17-18-19-20-21-22-33(46)52-32-23-24-41(8,53-30(6)45)38-35-34(27(2)3)37(49-28(4)43)39(50-29(5)44)42(26-48-42)36(35)31(51-38)25-40(32,7)47/h27,31-32,34-39,47H,9-26H2,1-8H3/t31-,32+,34-,35-,36-,37+,38-,39+,40+,41-,42-/m1/s1
SMILESCCCCCCCCCCCCCCCC(=O)O[C@H]1CC[C@@](C)(OC(C)=O)[C@@H]2O[C@H](C[C@]1(C)O)[C@@H]1[C@H]2[C@@H](C(C)C)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@]12CO2
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Similar chemical compounds in external resources
IdentifierDescription
CHEBI:68957
chebi:68957 		klymollin G
rel-(1S,2S,3S,4R,4aR,5R,6R,9S,10S,12R,12aS)-2,3,6-tris(acetyloxy)-10-hydroxy-6,10-dimethyl-4-(propan-2-yl)dodecahydro-2H-spiro[5,12-epoxybenzo[10]annulene-1,2'-oxiran]-9-yl hexadecanoate