Try beta.chemspider
- Double-bond stereo
- 5 of 5 defined stereocentres
(1S,4aS,5R,8aS)-5-[(2E)-3-{(2R)-8-[(5-Acetyl-2,4-dihydroxy-3,3-dimethyl-6-oxo-1,4-cyclohexadien-1-yl)methyl]-6-butyryl-5,7-dihydroxy-3,4-dihydro-2H-chromen-2-yl}-2-buten-1-yl]-1,4a-dimethyl-6-methylen edecahydro-1-naphthalenecarboxylic acid
CC1(C)C(O)=C(C(=O)C(CC2=C3O[C@H](CCC3=C(O)C(C(=O)CCC)=C2O)/C(/C)=C/C[C@@H]2C(=C)CC[C@H]3[C@@]2(C)CCC[C@]3(C)C(O)=O)=C1O)C(C)=O
InChI=1S/C42H54O10/c1-9-11-28(44)32-33(45)24-14-16-29(22(3)12-15-27-21(2)13-17-30-41(27,7)18-10-19-42(30,8)39(50)51)52-36(24)25(34(32)46)20-26-35(47)31(23(4)43)38(49)40(5,6)37(26)48/h12,27,29-30,45-46,48-49H,2,9-11,13-20H2,1,3-8H3,(H,50,51)/b22-12+/t27-,29-,30+,41+,42+/m1/s1
OFWNADRFWFVJIZ-CSTVGYCZSA-N
CSID:76803106, http://www.chemspider.com/Chemical-Structure.76803106.html (accessed 17:19, Jul 4, 2024)
Validated by Experts, Validated by Users, Non-Validated, Removed by Users
Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00
Click to predict properties on the Chemicalize site
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