(Q104914372)

English

(2S,13S,15S,16R,17S,19S,20S,21R)-17-methoxy-21-methyl-18-oxa-1,11-diazahexacyclo[11.8.0.02,16.04,12.05,10.015,20]henicosa-4(12),5,7,9-tetraen-19-ol

chemical compound

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Statements

instance of

group of stereoisomers

0 references

subclass of

ajmaline alkaloid

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mass

340.178692628 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₂₄N₂O₃

0 references

canonical SMILES

OC1OC(OC)C2C3N4C(C=5NC=6C=CC=CC6C5C3)CC2C1C4C

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isomeric SMILES

CO[C@H]1O[C@H](O)[C@H]2[C@@H]3C[C@H]4c5[nH]c6ccccc6c5C[C@@H]([C@H]13)N4[C@@H]2C

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found in taxon

Alstonia yunnanensis

1 reference

stated in

Monoterpenoid indole alkaloids from Alstonia yunnanensis

Identifiers

InChI

InChI=1S/C20H24N2O3/c1-9-16-12-8-15-18-11(10-5-3-4-6-13(10)21-18)7-14(22(9)15)17(12)20(24-2)25-19(16)23/h3-6,9,12,14-17,19-21,23H,7-8H2,1-2H3/t9-,12+,14+,15+,16-,17-,19+,20+/m1/s1

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InChIKey

ALUUTSZMHKEPEI-MWQMIPGJSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

ALUUTSZMHKEPEI-MWQMIPGJSA-N

(Q104914372)

(2S,13S,15S,16R,17S,19S,20S,21R)-17-methoxy-21-methyl-18-oxa-1,11-diazahexacyclo[11.8.0.02,16.04,12.05,10.015,20]henicosa-4(12),5,7,9-tetraen-19-ol

Statements

Identifiers

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