DAPHNANDRINE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C36H38N2O6
Molecular Weight	594.6967
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12CC3=CC(OC4=CC=C(C[C@]5([H])N(C)CCC6=C5C(OC7=CC1=C(CCN2)C=C7OC)=C(O)C(OC)=C6)C=C4)=C(OC)C=C3

InChI

InChIKey=REKCBEFSIKOPTD-IZLXSDGUSA-N

InChI=1S/C36H38N2O6/c1-38-14-12-24-19-33(42-4)35(39)36-34(24)28(38)16-21-5-8-25(9-6-21)43-31-17-22(7-10-29(31)40-2)15-27-26-20-32(44-36)30(41-3)18-23(26)11-13-37-27/h5-10,17-20,27-28,37,39H,11-16H2,1-4H3/t27-,28+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C36H38N2O6
Molecular Weight	594.6967
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:18:19 GMT 2023` Edited by `admin` on `Sat Dec 16 08:18:19 GMT 2023`
Record UNII	P9909Y937X
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DAPHNANDRINE

Common Name

English

O12'-METHYLDAPHNOLINE

Common Name

English

DAPHNANDRINE [MI]

Common Name

English

(+)-DAPHNANDRINE

Common Name

English

2H-1,24:12,15-DIETHENO-6,10-METHENO-16H-PYRIDO(2',3':17,18)(1,10)DIOXACYCLOEICOSINO(2,3,4-IJ)ISOQUINOLIN-22-OL, 3,4,4A,5,16A,17,18,19-OCTAHYDRO-9,21,26-TRIMETHOXY-17-METHYL-, (4AR,16AS)-

Systematic Name

English

Code System Code Type Description

CAS

1183-76-2