(Q105026028)

English

(4aR,5aR,8aS,13aS,15aS,15bR)-5a,12-dihydroxy-11-methoxy-2,4a,5,7,8,13a,15,15a,15b,16-decahydro4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinolin-14-one

chemical compound

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instance of

type of chemical entity

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subclass of

5a,12-Dihydroxy-11-methoxy-2,4a,5,7,8,13a,15,15a,15b,16-decahydro4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinolin-14-one

1 reference

based on heuristic

inferred from SMILES

mass

396.168521868 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₂H₂₄N₂O₅

0 references

canonical SMILES

O=C1N2C3=C(O)C(OC)=CC=C3C45CCN6CC7=CCOC(C1)C(C7CC64O)C25

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isomeric SMILES

COc1ccc2c(c1O)N1C(=O)C[C@@H]3OCC=C4CN5CC[C@@]26[C@@H]1[C@H]3[C@H]4C[C@]56O

0 references

found in taxon

Strychnos nux-vomica

1 reference

stated in

Alkaloids of Sri Lankan Strychnos nux-vomica

Identifiers

InChI

InChI=1S/C22H24N2O5/c1-28-14-3-2-13-18(19(14)26)24-16(25)8-15-17-12-9-22(27)21(13,20(17)24)5-6-23(22)10-11(12)4-7-29-15/h2-4,12,15,17,20,26-27H,5-10H2,1H3/t12-,15-,17-,20-,21-,22+/m0/s1

0 references

InChIKey

HCWYEQUXDRUQHN-WQDZIMBUSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

HCWYEQUXDRUQHN-WQDZIMBUSA-N

(Q105026028)

(4aR,5aR,8aS,13aS,15aS,15bR)-5a,12-dihydroxy-11-methoxy-2,4a,5,7,8,13a,15,15a,15b,16-decahydro4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinolin-14-one

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