(Q105313758)

English

(1S,14R)-9,20,21,25-tetramethoxy-15,30-dimethyl-7,23-dioxa-15,30-diazaheptacyclo[22.6.2.2³,⁶.1⁸,¹².1¹⁴,¹⁸.0²⁷,³¹.0²²,³³]hexatriaconta-3,5,8(34),9,11,18(33),19,21,24,26,31,35-dodecaene

chemical compound

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instance of

type of chemical entity

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subclass of

isoquinoline alkaloid

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mass

622.304287064 dalton

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1 reference

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C₃₈H₄₂N₂O₆

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canonical SMILES

O1C2=CC=C(C=C2)CC3C4=CC(OC=5C(OC)=C(OC)C=C6C5C(N(C)CC6)CC7=CC=C(OC)C1=C7)=C(OC)C=C4CCN3C

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isomeric SMILES

COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CCN1C)Oc1c(OC)c(OC)cc3c1[C@@H](C2)N(C)CC3

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found in taxon

Stephania erecta

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stated in

Cytotoxic and antimalarial bisbenzylisoquinoline alkaloids from Stephania erecta

Stephania pierrei

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stated in

Cytotoxic and antimalarial bisbenzylisoquinoline alkaloids from Stephania erecta

Berberis vulgaris

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stated in

Pharmacological and therapeutic effects of Berberis vulgaris and its active constituent, berberine

stated in

Isoquinoline alkaloids from Berberis Vulgaris subsp. Australis

Mahonia aquifolium

1 reference

stated in

Pharmacological and therapeutic effects of Berberis vulgaris and its active constituent, berberine

Atherosperma moschatum

1 reference

stated in

The alkaloids of Atherosperma moschatum Labill. I. Isolation of the alkaloids and structure of Berbamine

Berberis crataegina

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stated in

Alkaloids ofBerberis crataegina

Berberis stolonifera

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stated in

Bisbenzylisoquinoline biosynthesis in Berberis stolonifera cell cultures

Limaciopsis loangensis

1 reference

stated in

Alcaloïdes du Limaciopsis loangensis

Pycnarrhena manillensis

1 reference

stated in

Phaeanthine-2'a-N-oxide and Pycmanilline, New Bisbenzylisoquinoline Alkaloids from Pycnarrhena manillensis

Berberis duclouxiana

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stated in

Constituents of Mahonia siamensis

Berberis napaulensis

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stated in

Constituents of Mahonia siamensis

Mahonia bealei

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stated in

Studies on the Alkaloids of Berberidaceous Plants. V. : Alkaloids of Mahonia japonica DC. (2).

Berberis bealei

1 reference

stated in

Studies on the Alkaloids of Berberidaceous Plants. V. : Alkaloids of Mahonia japonica DC. (2).

Mahonia napaulensis

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stated in

Constituents of Mahonia siamensis

Identifiers

InChI

InChI=1S/C38H42N2O6/c1-39-15-13-25-20-32(42-4)34-22-28(25)29(39)17-23-7-10-27(11-8-23)45-33-19-24(9-12-31(33)41-3)18-30-36-26(14-16-40(30)2)21-35(43-5)37(44-6)38(36)46-34/h7-12,19-22,29-30H,13-18H2,1-6H3/t29-,30+/m0/s1

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InChIKey

WVTKBKWTSCPRNU-XZWHSSHBSA-N

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CAS Registry Number

477-57-6

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stated in

CAS (formerly Chemical Abstracts Service)

25 January 2022

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17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

WVTKBKWTSCPRNU-XZWHSSHBSA-N

1 reference

1 reference

matched by identifier from

InChIKey

WVTKBKWTSCPRNU-XZWHSSHBSA-N

UNII

84T861CP2N

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matched by identifier from

InChIKey

WVTKBKWTSCPRNU-XZWHSSHBSA-N

Probes And Drugs ID

PD062085

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(Q105313758)

(1S,14R)-9,20,21,25-tetramethoxy-15,30-dimethyl-7,23-dioxa-15,30-diazaheptacyclo[22.6.2.2³,⁶.1⁸,¹².1¹⁴,¹⁸.0²⁷,³¹.0²²,³³]hexatriaconta-3,5,8(34),9,11,18(33),19,21,24,26,31,35-dodecaene

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