(Q105195793)

English

(1R,17R)-11,27-dimethoxy-16,32-dimethyl-9,25,35,39-tetraoxa-16,32-diazanonacyclo[20.10.3.36,13.13,7.119,23.026,34.029,33.010,38.017,37]tetraconta-3(40),4,6,10,12,19(36),20,22,26,28,33,37-dodecaene

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

isoquinoline alkaloid

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mass

618.272986936 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₈H₃₈N₂O₆

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canonical SMILES

O1C2=CC=C3C=C2COC4=C(OC)C=C5C(=C14)C(N(C)CC5)CC6=CC=C7OC=8C(OCC7=C6)=C(OC)C=C9C8C(N(C)CC9)C3

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isomeric SMILES

COc1cc2c3c4c1OCc1cc(ccc1O4)C[C@@H]1c4c(cc(OC)c5c4Oc4ccc(cc4CO5)C[C@H]3N(C)CC2)CCN1C

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found in taxon

Cissampelos capensis

1 reference

stated in

Alkaloidal variation in cissampelos capensis (Menispermaceae).

Croton megalobotrys

1 reference

stated in

Alkaloidal variation in cissampelos capensis (Menispermaceae).

Identifiers

InChI

InChI=1S/C38H38N2O6/c1-39-11-9-23-17-31(41-3)35-37-33(23)27(39)15-21-5-7-30-25(13-21)19-44-36-32(42-4)18-24-10-12-40(2)28(34(24)38(36)46-30)16-22-6-8-29(45-37)26(14-22)20-43-35/h5-8,13-14,17-18,27-28H,9-12,15-16,19-20H2,1-4H3/t27-,28-/m1/s1

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InChIKey

OOYGKIWLQZTZTG-VSGBNLITSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

OOYGKIWLQZTZTG-VSGBNLITSA-N

(Q105195793)

(1R,17R)-11,27-dimethoxy-16,32-dimethyl-9,25,35,39-tetraoxa-16,32-diazanonacyclo[20.10.3.36,13.13,7.119,23.026,34.029,33.010,38.017,37]tetraconta-3(40),4,6,10,12,19(36),20,22,26,28,33,37-dodecaene

Statements

Identifiers

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