Try beta.chemspider
- Double-bond stereo
- 6 of 6 defined stereocentres
3-[(1S,3R,5Z,7E)-1,3,25-Trihydroxy-9,10-secocholesta-5,7,9,10-tetraen-11-yl]-2-propyn-1-yl acetate
O=C(OCC#C\C2=C\C(=C/C=C1\C(=C)[C@@H](O)C[C@H](O)C1)[C@@H]3CC[C@H]([C@H](C)CCCC(O)(C)C)[C@]3(C2)C)C
InChI=1S/C32H46O5/c1-21(9-7-15-31(4,5)36)28-13-14-29-26(12-11-25-18-27(34)19-30(35)22(25)2)17-24(20-32(28,29)6)10-8-16-37-23(3)33/h11-12,17,21,27-30,34-36H,2,7,9,13-16,18-20H2,1,3-6H3/b25-11-,26-12+/t21-,27-,28-,29+,30+,32-/m1/s1
XRMZLIWRUWAKBZ-SGYPUKBOSA-N
CSID:7826554, http://www.chemspider.com/Chemical-Structure.7826554.html (accessed 03:21, May 6, 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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