(Q105229865)

English

methyl (1R,15R,16S,20S)-8-methoxy-16-methyl-17-oxa-3,13-diazapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-2(10),4(9),5,7,18-pentaene-19-carboxylate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

Methyl 8-methoxy-16-methyl-17-oxa-3,13-diazapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-2(10),4(9),5,7,18-pentaene-19-carboxylate

1 reference

based on heuristic

inferred from SMILES

mass

382.189257312 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

methyl (1R,15R,16S,20R)-8-methoxy-16-methyl-17-oxa-3,13-diazapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-2(10),4(9),5,7,18-pentaene-19-carboxylate

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₂H₂₆N₂O₄

0 references

canonical SMILES

O=C(OC)C1=COC(C)C2CN3CCC=4C=5C(OC)=CC=CC5NC4C3CC12

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isomeric SMILES

COC(=O)C1=CO[C@@H](C)[C@H]2CN3CCc4c([nH]c5cccc(OC)c45)[C@H]3C[C@H]12

0 references

found in taxon

Mitragyna hirsuta

1 reference

stated in

Hirsuteine and mitrajavine from Mitragyna hirsuta

Mitragyna diversifolia

1 reference

stated in

The Mitragyna species of Asia. 8. The alkaloids of the leaves of Mitragyna javanica var. microphylla Koord and Valeton

Mitragyna speciosa

1 reference

stated in

The Mitragyna Species of Asia

Identifiers

InChI

InChI=1S/C22H26N2O4/c1-12-15-10-24-8-7-13-20-17(5-4-6-19(20)26-2)23-21(13)18(24)9-14(15)16(11-28-12)22(25)27-3/h4-6,11-12,14-15,18,23H,7-10H2,1-3H3/t12-,14-,15+,18+/m0/s1

0 references

InChIKey

QXSGZNGSUBCBAZ-CTNYNGJSSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

QXSGZNGSUBCBAZ-CTNYNGJSSA-N

1 reference

(Q105229865)

methyl (1R,15R,16S,20S)-8-methoxy-16-methyl-17-oxa-3,13-diazapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-2(10),4(9),5,7,18-pentaene-19-carboxylate

Statements

Identifiers

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