input word = C00026643

Metabolite InformationStructural formula
Name Psychopentamine
(+)-Psychopentamine
Formula C55H62N10
Mw 862.51589205
CAS RN 754215-32-2
C_ID C00026643 ,
InChIKey UYRNOVZHBHKIID-UHFFFAOYNA-N
InChICode InChI=1S/C55H62N10/c1-56-27-22-34-33-65(44-18-9-6-12-36(34)44)45-19-11-15-39-47(45)60-48-52(39,23-28-61(48)2)35-20-21-43-41(32-35)55(26-31-63(4)50(55)58-43)54-25-30-64(5)51(54)59-46-38(14-10-16-40(46)54)53-24-29-62(3)49(53)57-42-17-8-7-13-37(42)53/h6-21,32-33,48-51,56-60H,22-31H2,1-5H3/t48-,49-,50+,51+,52+,53-,54-,55-/m1/s1
SMILES c12c(cccc1)n(cc2CCNC)c1cccc2c1N[C@H]1[C@@]2(CCN1C)c1cc2c(cc1)N[C@@H]1[C@]2(CCN1C)[C@]12[C@H](N(CC1)C)Nc1c2cccc1[C@@]12[C@@H](N(CC1)C)Nc1c2cccc1
Start Substs in Alk. Biosynthesis (Prediction) L-Trp
Organism
Kingdom Family Species Reference
PlantaeRubiaceaePsychotria rostrata Ref.
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