Name |
14-O-Cinnamoylneoline |
Formula |
C33H45NO7 |
Mw |
567.3196028 |
CAS RN |
640282-27-5 |
C_ID |
C00031504
,
|
InChIKey |
QNCJLCAJHJQEGR-VAWYXSNFNA-N |
InChICode |
InChI=1S/C33H45NO7/c1-5-34-17-31(18-38-2)14-13-23(35)33-21-15-20-22(39-3)16-32(37,26(30(33)34)28(40-4)29(31)33)25(21)27(20)41-24(36)12-11-19-9-7-6-8-10-19/h6-12,20-23,25-30,35,37H,5,13-18H2,1-4H3/b12-11+/t20-,21-,22+,23-,25-,26-,27-,28-,29+,30+,31-,32-,33-/m1/s1 |
SMILES |
N1(CC)[C@H]2[C@H]3[C@H]([C@@H]4[C@@]2([C@@H]2C[C@@H]5[C@H](C[C@]3([C@H]2[C@@H]5OC(=O)/C=C/c2ccccc2)O)OC)[C@@H](CC[C@@]4(C1)COC)O)OC |
Start Substs in Alk. Biosynthesis (Prediction) |
L-Trp Secologanin |
Organism |
Kingdom |
Family |
Species |
Reference |
Plantae | Ranunculaceae | Aconitum carmichaeli | Ref. |
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