8JJ
5'-O-[(R)-{[(7beta,8alpha,9beta,10alpha,13alpha,16beta)-7,16-dihydroxy-18-oxokauran-18-yl]oxy}(hydroxy)phosphoryl]adenosine
Find entries where: 8JJ
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
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Name | 5'-O-[(R)-{[(7beta,8alpha,9beta,10alpha,13alpha,16beta)-7,16-dihydroxy-18-oxokauran-18-yl]oxy}(hydroxy)phosphoryl]adenosine |
Identifiers | n/a |
Formula | C30 H44 N5 O10 P |
Molecular Weight | 665.672 |
Type | NON-POLYMER |
Isomeric SMILES | C[C@@]12CCC[C@@]([C@H]1C[C@H]([C@]34[C@H]2CC[C@H](C3)[C@](C4)(C)O)O)(C)C(=O)OP(=O)(O)OC[C@@H]5[C@H]([C@H]([C@@H](O5)n6cnc7c6ncnc7N)O)O |
InChI | InChI=1S/C30H44N5O10P/c1-27-7-4-8-28(2,18(27)9-19(36)30-10-15(5-6-17(27)30)29(3,40)12-30)26(39)45-46(41,42)43-11-16-21(37)22(38)25(44-16)35-14-34-20-23(31)32-13-33-24(20)35/h13-19,21-22,25,36-38,40H,4-12H2,1-3H3,(H,41,42)(H2,31,32,33)/t15-,16-,17+,18+,19-,21-,22-,25-,27+,28-,29-,30-/m1/s1 |
InChIKey | LGCUMWKRNQUJBL-BSUNFUJCSA-N |
Chemical Details | |
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Formal Charge | 0 |
Atom Count | 90 |
Chiral Atom Count | 12 |
Bond Count | 96 |
Aromatic Bond Count | 10 |
Related Resource References
Resource Name | Reference |
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PubChem | 124201666 |