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berkeleyone C

PropertiesImageOccurences in reactions
MNX_IDMNXM103051Image of MNXM103051
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC26H34O7
charge0
mass458.23045
referencechebi:69027
InChIKeyHBZLILHFZMWEGE-QFRJCEMRSA-N
InChIInChI=1S/C26H34O7/c1-14(2)16-9-12-24(6)17(22(16,4)11-10-18(27)28)13-23(5)15(3)26(24,21(31)33-8)20(30)25(7,32)19(23)29/h9,17,32H,1,3,10-13H2,2,4-8H3,(H,27,28)/t17-,22+,23+,24-,25-,26-/m0/s1
SMILESC=C(C)C1=CC[C@@]2(C)[C@@H](C[C@]3(C)C(=C)[C@@]2(C(=O)OC)C(=O)[C@@](C)(O)C3=O)[C@]1(C)CCC(=O)O
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Similar chemical compounds in external resources
IdentifierDescription
CHEBI:69027
chebi:69027
berkeleyone C
rel-3-[(1S,4aS,5R,7S,9R,10aS)-7-hydroxy-5-(methoxycarbonyl)-1,4a,7,9-tetramethyl-11-methylidene-6,8-dioxo-2-(prop-1-en-2-yl)-1,4,4a,5,6,7,8,9,10,10a-decahydro-5,9-methanobenzo[8]annulen-1-yl]propanoic acid