Name |
Isocyasterone |
Formula |
C29H44O8 |
Mw |
520.30361838 |
CAS RN |
54082-42-7 |
C_ID |
C00031896
,
|
InChIKey |
NEFYSBQJYCICOG-NANFOPHXNA-N |
InChICode |
InChI=1S/C29H44O8/c1-14-16(15(2)37-25(14)34)10-24(33)28(5,35)23-7-9-29(36)18-11-20(30)19-12-21(31)22(32)13-26(19,3)17(18)6-8-27(23,29)4/h11,14-17,19,21-24,31-33,35-36H,6-10,12-13H2,1-5H3/t14-,15-,16+,17+,19+,21-,22+,23+,24-,26-,27-,28-,29-/m1/s1 |
SMILES |
[C@H]1([C@@H](C[C@@H]2[C@](C1)([C@@H]1C(=CC2=O)[C@]2([C@](CC1)([C@H](CC2)[C@@]([C@@H](C[C@@H]1[C@H](OC(=O)[C@@H]1C)C)O)(C)O)C)O)C)O)O |
Start Substs in Alk. Biosynthesis (Prediction) |
|
Organism |
Kingdom |
Family |
Species |
Reference |
Plantae | Amaranthaceae | Cyathula capitata | Ref. |
Plantae | Labiatae | Ajuga taiwanensis | Ref. |
|
|
zoom in
|