(Q105215932)

English

methyl (1R,9S,10S,12R,13R,20S)-9-methoxy-12-methyl-11-oxa-8,17-diazahexacyclo[11.6.1.110,13.01,9.02,7.017,20]henicosa-2,4,6,14-tetraene-10-carboxylate

chemical compound

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instance of

type of chemical entity

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subclass of

methyl (1R,9S,12R,13R,20S)-9-methoxy-12-methyl-11-oxa-8,17-diazahexacyclo[11.6.1.1¹⁰,¹³.0¹,⁹.0²,⁷.0¹⁷,²⁰]henicosa-2,4,6,14-tetraene-10-carboxylate

1 reference

based on heuristic

inferred from SMILES

methyl (1R,9S,12S,13R,20S)-9-methoxy-12-methyl-11-oxa-8,17-diazahexacyclo[11.6.1.1¹⁰,¹³.0¹,⁹.0²,⁷.0¹⁷,²⁰]henicosa-2,4,6,14-tetraene-10-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,9S,10S,12S,13R,20S)-9-methoxy-12-methyl-11-oxa-8,17-diazahexacyclo[11.6.1.110,13.01,9.02,7.017,20]henicosa-2,4,6,14-tetraene-10-carboxylate

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₂H₂₆N₂O₄

0 references

canonical SMILES

O=C(OC)C12OC(C)C3(C=CCN4CCC5(C=6C=CC=CC6NC15OC)C43)C2

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isomeric SMILES

COC(=O)[C@]12C[C@]3(C=CCN4CC[C@@]5(c6ccccc6N[C@@]15OC)[C@@H]43)[C@@H](C)O2

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found in taxon

Catharanthus ovalis

1 reference

stated in

Alcaloïdes mono-indoliques de Catharanthus ovalis

Identifiers

InChI

InChI=1S/C22H26N2O4/c1-14-19-9-6-11-24-12-10-20(17(19)24)15-7-4-5-8-16(15)23-22(20,27-3)21(13-19,28-14)18(25)26-2/h4-9,14,17,23H,10-13H2,1-3H3/t14-,17+,19-,20-,21-,22+/m1/s1

0 references

InChIKey

PWOOYNOBJFJZLT-MQVQQYNVSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

PWOOYNOBJFJZLT-MQVQQYNVSA-N

(Q105215932)

methyl (1R,9S,10S,12R,13R,20S)-9-methoxy-12-methyl-11-oxa-8,17-diazahexacyclo[11.6.1.110,13.01,9.02,7.017,20]henicosa-2,4,6,14-tetraene-10-carboxylate

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