Try beta.chemspider
- Double-bond stereo
- 4 of 6 defined stereocentres
({(2E)-2-[(3aS,5R)-5-Hydroxy-4-[(3S,4S)-3-hydroxy-4-methyl-1,6-nonadiyn-1-yl]hexahydro-2(1H)-pentalenylidene]ethyl}oxy)acetic acid
CCC#CC[C@H](C)[C@@H](C#CC1[C@@H](CC2[C@@H]1C/C(=C/COCC(=O)O)/C2)O)O
InChI=1S/C22H30O5/c1-3-4-5-6-15(2)20(23)8-7-18-19-12-16(9-10-27-14-22(25)26)11-17(19)13-21(18)24/h9,15,17-21,23-24H,3,6,10-14H2,1-2H3,(H,25,26)/b16-9+/t15-,17?,18?,19-,20+,21+/m0/s1
ARUGKOZUKWAXDS-JRGCCMQMSA-N
CSID:23192171, http://www.chemspider.com/Chemical-Structure.23192171.html (accessed 11:50, May 10, 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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