| Name |
Sculponin D
(-)-Sculponin D |
| Formula |
C40H48O2 |
| Mw |
560.36543078 |
| CAS RN |
1182713-59-2 |
| C_ID |
C00048106
, 
|
| InChIKey |
UKVLVCQUVUORIL-JXWRTJHUNA-N |
| InChICode |
InChI=1S/C40H48O12/c1-34-6-4-22-38(15-48-29(26(34)38)46-13-34)24-20(41)9-17-11-36(24,32(44)50-22)28-19(17)3-8-40(52-28)18-10-21(42)25-37(12-18,31(40)43)33(45)51-23-5-7-35(2)14-47-30-27(35)39(23,25)16-49-30/h17-18,20-27,29-30,41-42H,3-16H2,1-2H3/t17-,18-,20-,21-,22+,23+,24-,25-,26-,27-,29+,30+,34+,35+,36+,37+,38+,39+,40?/m1/s1 |
| SMILES |
C[C@]12CC[C@@H]3OC(=O)[C@@]45C[C@@H](C[C@@H](O)[C@H]4[C@]34CO[C@H](OC1)[C@H]24)[C@@]1(CCC2=C(O1)[C@]13C[C@H]2C[C@@H](O)[C@H]1[C@]12CO[C@@H]4OC[C@](C)(CC[C@@H]1OC3=O)[C@@H]42)C5=O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Labiatae | Isodon sculponeatus | Ref. |
|
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