Try beta.chemspider
- Double-bond stereo
- 9 of 9 defined stereocentres
(7S,9E,11S,12R,13S,14R,15R,16R,17S,18S,19E,21E)-26-{[(4-Cyclopentyl-1-piperazinyl)imino]methyl}-2,15,17,27,29-pentahydroxy-11-methoxy-3,7,12,14,16,18,22-heptamethyl-6,23-dioxo-8,30-dioxa-24-azatetracy clo[23.3.1.1~4,7~.0~5,28~]triaconta-1(29),2,4,9,19,21,25,27-octaen-13-yl acetate
CO[C@H]1C=CO[C@@]2(C)OC3=C(C4C(C(O)=C3C)=C(O)C(NC(=O)C(C)=CC=C[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](OC(C)=O)[C@@H]1C)=C(C=NN1CCN(CC1)C1CCCC1)C=4O)C2=O |t:3,25,27|
InChI=1S/C47H64N4O12/c1-24-13-12-14-25(2)46(59)49-37-32(23-48-51-20-18-50(19-21-51)31-15-10-11-16-31)41(56)34-35(42(37)57)40(55)29(6)44-36(34)45(58)47(8,63-44)61-22-17-33(60-9)26(3)43(62-30(7)52)28(5)39(54)27(4)38(24)53/h12-14,17,22-24,26-28,31,33,38-39,43,53-57H,10-11,15-16,18-21H2,1-9H3,(H,49,59)/b13-12+,22-17+,25-14+,48-23?/t24-,26+,27+,28+,33-,38-,39+,43+,47-/m0/s1
WDZCUPBHRAEYDL-RDKOBYJASA-N
CSID:78431498, http://www.chemspider.com/Chemical-Structure.78431498.html (accessed 18:29, Apr 25, 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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