(Q105138807)

English

[(1R,2R,3S,5S,7R,10S,11R,12S,13S,14R,16R,17S,18S,19R)-4-ethyl-18-hydroxy-14,16-dimethoxy-10-methyl-6-oxa-4-azaheptacyclo[15.2.1.02,7.02,11.03,13.05,10.014,19]icosan-12-yl] acetate

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

(4-Ethyl-18-hydroxy-14,16-dimethoxy-10-methyl-6-oxa-4-azaheptacyclo[15.2.1.02,7.02,11.03,13.05,10.014,19]icosan-12-yl) acetate

1 reference

based on heuristic

inferred from SMILES

mass

447.262087904 dalton

1 reference

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₅H₃₇NO₆

0 references

canonical SMILES

O=C(OC1C2C3N(CC)C4OC5CCC4(C)C1C53C6CC7C(OC)CC2(OC)C6C7O)C

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isomeric SMILES

CCN1[C@H]2O[C@@H]3CC[C@@]2(C)[C@@H]2[C@H](OC(C)=O)[C@@H]4[C@H]1[C@]32[C@@H]1C[C@H]2[C@H](O)[C@@H]1[C@]4(OC)C[C@H]2OC

0 references

found in taxon

Delphinium favargeri

1 reference

stated in

Norditerpenoid alkaloids from Delphinium peregrinum var. elongatum

Identifiers

InChI

InChI=1S/C25H37NO6/c1-6-26-21-17-19(31-11(2)27)20-23(3)8-7-15(32-22(23)26)25(20,21)13-9-12-14(29-4)10-24(17,30-5)16(13)18(12)28/h12-22,28H,6-10H2,1-5H3/t12-,13-,14-,15-,16-,17-,18+,19-,20+,21+,22+,23+,24-,25-/m1/s1

0 references

InChIKey

KCKWLTSMSXSQHY-MUKYUAQSSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

KCKWLTSMSXSQHY-MUKYUAQSSA-N

(Q105138807)

[(1R,2R,3S,5S,7R,10S,11R,12S,13S,14R,16R,17S,18S,19R)-4-ethyl-18-hydroxy-14,16-dimethoxy-10-methyl-6-oxa-4-azaheptacyclo[15.2.1.02,7.02,11.03,13.05,10.014,19]icosan-12-yl] acetate

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Identifiers

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