- Double-bond stereo
- 6 of 6 defined stereocentres
(2Z,4S,4aR,5S,5aR,6R,12aS)-2-[Amino(hydroxy)methylene]-4-(dimethylamino)-5,10,11,12a-tetrahydroxy-6-methyl-4a,5a,6,12a-tetrahydro-1,3,12(2H,4H,5H)-tetracenetrione hydrate (1:1)
C[C@H]1c2cccc(c2C(=C3[C@@H]1[C@@H]([C@H]4[C@@H](C(=O)/C(=C(\N)/O)/C(=O)[C@]4(C3=O)O)N(C)C)O)O)O.O
InChI=1S/C22H24N2O8.H2O/c1-7-8-5-4-6-9(25)11(8)16(26)12-10(7)17(27)14-15(24(2)3)18(28)13(21(23)31)20(30)22(14,32)19(12)29;/h4-7,10,14-15,17,25-27,31-32H,23H2,1-3H3;1H2/b21-13-;/t7-,10+,14+,15-,17-,22-;/m0./s1
ADAURKPGCFUREH-UQVCFKGQSA-N
CSID:4445537, http://www.chemspider.com/Chemical-Structure.4445537.html (accessed 13:24, Mar 29, 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
No predicted properties have been calculated for this compound.
Click to predict properties on the Chemicalize site
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