Try beta.chemspider
- Double-bond stereo
- 4 of 5 defined stereocentres
2-{(4S,5S,5aS,9aS)-4-Hydroxy-6,6,9a-trimethyl-5-[(2E,4E,6E)-2,4,6-octatrienoyloxy]-1-oxo-1,3,4,5,5a,6,7,8,9,9a-decahydro-2H-benzo[e]isoindol-2-yl}pentanedioic acid
C/C=C/C=C/C=C/C(=O)O[C@@H]1[C@H](C2=C(C(=O)N(C2)C(CCC(=O)O)C(=O)O)[C@@]3([C@@H]1C(CCC3)(C)C)C)O
InChI=1S/C28H37NO8/c1-5-6-7-8-9-11-20(32)37-23-22(33)17-16-29(18(26(35)36)12-13-19(30)31)25(34)21(17)28(4)15-10-14-27(2,3)24(23)28/h5-9,11,18,22-24,33H,10,12-16H2,1-4H3,(H,30,31)(H,35,36)/b6-5+,8-7+,11-9+/t18?,22-,23+,24-,28+/m0/s1
DUJMJQPOBYAAIO-WGVPGFFFSA-N
CSID:64875107, http://www.chemspider.com/Chemical-Structure.64875107.html (accessed 05:13, 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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