(Q105174229)

English

Alstolactone

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

17-Ethylidene-3-methyl-15-oxa-3,20-diazapentacyclo[10.7.1.02,10.04,9.013,18]icosa-2(10),4,6,8-tetraen-16-one

1 reference

based on heuristic

inferred from SMILES

mass

322.168127944 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(1S,12S,13R,17E,18R)-17-ethylidene-3-methyl-15-oxa-3,20-diazapentacyclo[10.7.1.02,10.04,9.013,18]icosa-2(10),4,6,8-tetraen-16-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(1S,12S,13R,17Z,18R)-17-ethylidene-3-methyl-15-oxa-3,20-diazapentacyclo[10.7.1.02,10.04,9.013,18]icosa-2(10),4,6,8-tetraen-16-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₀H₂₂N₂O₂

0 references

canonical SMILES

O=C1OCC2C3NC(C4=C(C=5C=CC=CC5N4C)C3)CC2C1=CC

0 references

isomeric SMILES

C/C=C1\C(=O)OC[C@H]2[C@H]3Cc4c(n(C)c5ccccc45)[C@@H](C[C@@H]12)N3

0 references

found in taxon

Alstonia angustifolia

1 reference

stated in

Alkaloids from Alstonia angustifolia

Identifiers

InChI

InChI=1S/C20H22N2O2/c1-3-11-13-8-17-19-14(12-6-4-5-7-18(12)22(19)2)9-16(21-17)15(13)10-24-20(11)23/h3-7,13,15-17,21H,8-10H2,1-2H3/b11-3-/t13-,15+,16+,17+/m0/s1

0 references

InChIKey

MXJZROHBCMNZRV-CUPCYBJWSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

MXJZROHBCMNZRV-CUPCYBJWSA-N

1 reference

(Q105174229)

Alstolactone

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Identifiers

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