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2,3-dihydrowithaferin A

PropertiesImageOccurences in reactions
MNX_IDMNXM101564Image of MNXM101564
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC28H40O6
charge0
mass472.28249
referencechebi:69124
InChIKeyYRXCLNDPESBJHL-CKNDUULBSA-N
InChIInChI=1S/C28H40O6/c1-14-11-21(33-25(32)17(14)13-29)15(2)18-5-6-19-16-12-24-28(34-24)23(31)8-7-22(30)27(28,4)20(16)9-10-26(18,19)3/h15-16,18-21,23-24,29,31H,5-13H2,1-4H3/t15-,16-,18+,19-,20-,21+,23-,24+,26+,27-,28+/m0/s1
SMILESCC1=C(CO)C(=O)O[C@@H]([C@@H](C)[C@H]2CC[C@H]3[C@@H]4C[C@H]5O[C@]56[C@@H](O)CCC(=O)[C@]6(C)[C@H]4CC[C@@]32C)C1
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Similar chemical compounds in external resources
IdentifierDescription
CHEBI:69124
chebi:69124
2,3-dihydrowithaferin A
(22R)-4beta,27-dihydroxy-5beta,6beta:22,26-diepoxyergost-24-ene-1,26-dione