(Q105122555)

English

Mitrafo;ine

chemical compound

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instance of

type of chemical entity

0 references

subclass of

methyl (E)-2-[(6'R,7'S)-6'-ethyl-4-hydroxy-2-oxospiro[1H-indole-3,1'-3,5,6,7,8,8a-hexahydro-2H-indolizine]-7'-yl]-3-methoxyprop-2-enoate

1 reference

based on heuristic

inferred from SMILES

methyl (2E)-2-{6'-ethyl-2,4-dihydroxy-3',5',6',7',8',8'a-hexahydro-2'H-spiro[indole-3,1'-indolizin]-7'-yl}-3-methoxyprop-2-enoate

1 reference

based on heuristic

inferred from SMILES

methyl 2-(6'-ethyl-4-hydroxy-2-oxospiro[1H-indole-3,1'-3,5,6,7,8,8a-hexahydro-2H-indolizine]-7'-yl)-3-methoxyprop-2-enoate

1 reference

based on heuristic

inferred from SMILES

mass

400.199821996 dalton

1 reference

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

methyl (E)-2-[(3S,6'R,7'S,8'aS)-6'-ethyl-4-hydroxy-2-oxospiro[1H-indole-3,1'-3,5,6,7,8,8a-hexahydro-2H-indolizine]-7'-yl]-3-methoxyprop-2-enoate

2 references

based on heuristic

inferred from InChIKey

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

methyl (Z)-2-[(3R,6'S,7'S,8'aR)-6'-ethyl-4-hydroxy-2-oxospiro[1H-indole-3,1'-3,5,6,7,8,8a-hexahydro-2H-indolizine]-7'-yl]-3-methoxyprop-2-enoate

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

methyl (E)-2-[(3R,6'S,7'S,8'aS)-6'-ethyl-4-hydroxy-2-oxospiro[1H-indole-3,1'-3,5,6,7,8,8a-hexahydro-2H-indolizine]-7'-yl]-3-methoxyprop-2-enoate

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

methyl (Z)-2-[(3R,6'S,7'R,8'aS)-6'-ethyl-4-hydroxy-2-oxospiro[1H-indole-3,1'-3,5,6,7,8,8a-hexahydro-2H-indolizine]-7'-yl]-3-methoxyprop-2-enoate

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₂H₂₈N₂O₅

0 references

canonical SMILES

CCC1CN2CCC3(C(=O)Nc4cccc(O)c43)C2CC1C(=COC)C(=O)OC

0 references

isomeric SMILES

CC[C@@H]1CN2CC[C@@]3(C(=O)Nc4cccc(O)c43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC

0 references

found in taxon

Mitragyna rotundifolia

1 reference

stated in

THE ALKALOIDS OF MITRAGYNA ROTUNDIFOLIA. I

Mitragyna speciosa

1 reference

stated in

The Mitragyna Species of Asia

Identifiers

InChI

InChI=1S/C22H28N2O5/c1-4-13-11-24-9-8-22(19-16(23-21(22)27)6-5-7-17(19)25)18(24)10-14(13)15(12-28-2)20(26)29-3/h5-7,12-14,18,25H,4,8-11H2,1-3H3,(H,23,27)/b15-12+/t13-,14+,18+,22-/m1/s1

0 references

InChIKey

IXWWTVSMMIIIFZ-MDJVJMPMSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

IXWWTVSMMIIIFZ-MDJVJMPMSA-N

1 reference

(Q105122555)

Mitrafo;ine

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