input word = C00041666

Metabolite InformationStructural formula
Name Methylene-bismehranine
(-)-Methylene-bismehranine
Formula C41H52N4O2
Mw 632.40902693
CAS RN 220327-18-4
C_ID C00041666 ,
InChIKey SGLCOXUGVSCZLV-VFPKBNONNA-N
InChICode InChI=1S/C41H52N4O2/c1-5-38-13-11-32-40(15-17-44(36(38)40)22-30-34(38)46-30)26-20-24(7-9-28(26)42(32)3)19-25-8-10-29-27(21-25)41-16-18-45-23-31-35(47-31)39(6-2,37(41)45)14-12-33(41)43(29)4/h7-10,20-21,30-37H,5-6,11-19,22-23H2,1-4H3/t30-,31-,32+,33+,34-,35-,36+,37+,38-,39-,40+,41+/m1/s1
SMILES c1c(cc2c(c1)N([C@@H]1[C@]32[C@@H]2[C@](CC1)([C@H]1[C@@H](CN2CC3)O1)CC)C)Cc1ccc2c(c1)[C@@]13[C@@H](N2C)CC[C@]2([C@@H]1N(C[C@@H]1[C@H]2O1)CC3)CC
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr Secologanin
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeTabernaemontana bovina Ref.
zoom in