(Q104950407)

English

methyl (1S,3R,4R,4aR,5aS,6S,10aR)-3-hydroxy-1-methyl-2'-oxospiro[1,3,4,4a,5,5a,7,8,10,10a-decahydropyrano[3,4-f]indolizine-6,3'-1H-indole]-4-carboxylate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

methyl 3-hydroxy-1-methyl-2'-oxospiro[1,3,4,4a,5,5a,7,8,10,10a-decahydropyrano[3,4-f]indolizine-6,3'-1H-indole]-4-carboxylate

1 reference

based on heuristic

inferred from SMILES

mass

386.184171932 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

methyl (1S,3R,4R,4aS,5aS,6S,10aR)-3-hydroxy-1-methyl-2'-oxospiro[1,3,4,4a,5,5a,7,8,10,10a-decahydropyrano[3,4-f]indolizine-6,3'-1H-indole]-4-carboxylate

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

methyl (1S,3R,4R,4aS,5aS,6R,10aR)-3-hydroxy-1-methyl-2'-oxospiro[1,3,4,4a,5,5a,7,8,10,10a-decahydropyrano[3,4-f]indolizine-6,3'-1H-indole]-4-carboxylate

1 reference

based on heuristic

inferred from InChI

methyl (1S,3R,4R,4aR,5aS,6R,10aR)-3-hydroxy-1-methyl-2'-oxospiro[1,3,4,4a,5,5a,7,8,10,10a-decahydropyrano[3,4-f]indolizine-6,3'-1H-indole]-4-carboxylate

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₁H₂₆N₂O₅

0 references

canonical SMILES

COC(=O)C1C(O)OC(C)C2CN3CCC4(C(=O)Nc5ccccc54)C3CC21

0 references

isomeric SMILES

COC(=O)[C@@H]1[C@@H]2C[C@@H]3N(CC[C@@]34C(=O)Nc3ccccc34)C[C@@H]2[C@H](C)O[C@H]1O

0 references

found in taxon

Mitragyna hirsuta

1 reference

stated in

New heteroyohimbine-type oxindole alkaloid from the leaves of Thai Mitragyna hirsuta

Identifiers

InChI

InChI=1S/C21H26N2O5/c1-11-13-10-23-8-7-21(14-5-3-4-6-15(14)22-20(21)26)16(23)9-12(13)17(18(24)27-2)19(25)28-11/h3-6,11-13,16-17,19,25H,7-10H2,1-2H3,(H,22,26)/t11-,12+,13+,16-,17-,19+,21-/m0/s1

0 references

InChIKey

BZEARLNMWSCOOH-FLMVLGGISA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

BZEARLNMWSCOOH-FLMVLGGISA-N

(Q104950407)

methyl (1S,3R,4R,4aR,5aS,6S,10aR)-3-hydroxy-1-methyl-2'-oxospiro[1,3,4,4a,5,5a,7,8,10,10a-decahydropyrano[3,4-f]indolizine-6,3'-1H-indole]-4-carboxylate

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Identifiers

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