Try beta.chemspider
- 5 of 6 defined stereocentres
2,4,6-Trihydroxy-5-{3-methyl-1-[(1aR,4aR,7S,7aR,7bR)-1,1,7-trimethyl-4-methylenedecahydro-1H-cyclopropa[e]azulen-7-yl]butyl}isophthalaldehyde
CC1(C)[C@@H]2[C@H]1CCC(=C)[C@@H]1CC[C@@](C)([C@H]12)C(CC(C)C)C1C(O)=C(C=O)C(O)=C(C=O)C=1O
InChI=1S/C28H38O5/c1-14(2)11-20(21-25(32)17(12-29)24(31)18(13-30)26(21)33)28(6)10-9-16-15(3)7-8-19-23(22(16)28)27(19,4)5/h12-14,16,19-20,22-23,31-33H,3,7-11H2,1-2,4-6H3/t16-,19+,20?,22+,23+,28+/m0/s1
IEWHEHWXBLPFER-JXUHKHASSA-N
CSID:84487498, http://www.chemspider.com/Chemical-Structure.84487498.html (accessed 05:03, Jun 1, 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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