Name |
3-Epiervafolidine Epiervafolidine |
Formula |
C40H46N4O5 |
Mw |
662.34682061 |
CAS RN |
80338-95-0 |
C_ID |
C00025747
,
|
InChIKey |
GWZISSWNXUYCSI-UHFFFAOYNA-N |
InChICode |
InChI=1S/C40H46N4O5/c1-4-35-19-25-30-37(5-2,49-40(25)39(24-11-7-9-13-27(24)42-40)15-16-43(33(35)39)20-28-31(35)48-28)21-36-18-22(32(45)47-3)29-38(34(36)46,14-17-44(30)36)23-10-6-8-12-26(23)41-29/h6-13,25,28,30-31,33-34,41-42,46H,4-5,14-21H2,1-3H3/t25-,28-,30+,31-,33+,34-,35-,36+,37+,38-,39-,40+/m0/s1 |
SMILES |
c1ccc2c(c1)[C@@]13C(=C(C[C@]4([C@@H]1O)C[C@@]1([C@H](N4CC3)[C@H]3[C@@]4(O1)[C@]1([C@H]5[C@@](C3)([C@@H]3[C@H](CN5CC1)O3)CC)c1c(N4)cccc1)CC)C(=O)OC)N2 |
Start Substs in Alk. Biosynthesis (Prediction) |
L-Trp Secologanin |
Organism |
Kingdom |
Family |
Species |
Reference |
Plantae | Apocynaceae | Tabernaemontana pandacaqui Poir. | Ref. |
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