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8,8a-epoxymorellic acid

PropertiesImageOccurences in reactions
MNX_IDMNXM102216Image of MNXM102216
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC33H36O9
charge0
mass576.23593
referencechebi:66402
InChIKeyDHCUJGJZVIRMQU-ZZBIGSJJSA-N
InChIInChI=1S/C33H36O9/c1-15(2)8-9-18-23-17(11-12-29(4,5)39-23)21(34)20-24(18)40-33-27-22(35)19(26-32(33,42-26)25(20)36)14-31(33,30(6,7)41-27)13-10-16(3)28(37)38/h8,10-12,19,26-27,34H,9,13-14H2,1-7H3,(H,37,38)/b16-10-/t19-,26?,27+,31+,32?,33+/m1/s1
SMILESCC(C)=CCc1c2c(c(O)c3c1O[C@@]14[C@H]5OC(C)(C)[C@]1(C/C=C(/C)C(=O)O)C[C@H](C5=O)C1OC14C3=O)C=CC(C)(C)O2
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Similar chemical compounds in external resources
IdentifierDescription
CHEBI:66402
chebi:66402
8,8a-epoxymorellic acid
(2Z)-4-[(2S,3aR,6S,6aR)-13-hydroxy-5,5,10,10-tetramethyl-8-(3-methylbut-2-en-1-yl)-3,14-dioxo-1a,2,3,3a-tetrahydro-10H,14H-2,6-methanofuro[3,2-g]oxireno[k]pyrano[3,2-b]xanthen-6(5H)-yl]-2-methylbut-2-enoic acid