| Name |
[3R-(3alpha,4beta,5alpha,5aalpha,6alpha,9beta,9aalpha,10R*)]-5-(Acetyloxy)-6-(benzoyloxy)octahydro-4,9-dihydroxy-2,2,5a,9-tetramethyl-2H-3,9a-methano-1-benzoxepin-10-yl ester 3-pyridinecarboxylic acid |
| Formula |
C30H35NO9 |
| Mw |
553.23118172 |
| CAS RN |
110559-19-8 |
| C_ID |
C00013168
, 
|
| InChIKey |
QJLDVVCNHSFSOM-YIAWJAAHNA-N |
| InChICode |
InChI=1S/C30H35NO9/c1-17(32)37-24-22(33)21-23(39-26(35)19-12-9-15-31-16-19)30(40-27(21,2)3)28(4,36)14-13-20(29(24,30)5)38-25(34)18-10-7-6-8-11-18/h6-12,15-16,20-24,33,36H,13-14H2,1-5H3/t20-,21+,22-,23+,24+,28-,29-,30-/m0/s1 |
| SMILES |
[C@H]12[C@@H]([C@H]([C@]3([C@]([C@@](CC[C@@H]3OC(=O)c3ccccc3)(C)O)(OC1(C)C)[C@@H]2OC(=O)c1cccnc1)C)OC(=O)C)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
L-Asp L-His |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Celastraceae | Orthosphenia mexicana | Ref. |
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