LYCACONITINE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C36H48N2O10
Molecular Weight	668.7737
Optical Activity	UNSPECIFIED
Defined Stereocenters	13 / 13
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@]12[C@@H](OC)[C@@H]3C[C@H]1[C@]45[C@@H]6N(CC)C[C@](COC(=O)C7=C(C=CC=C7)N8C(=O)CCC8=O)(CC[C@@H]4OC)[C@@]5([H])[C@H](OC)[C@]6(O)[C@@]2(O)C[C@@H]3OC

InChI

InChIKey=KFXVNXQXPRPLQA-JEUORDJTSA-N

InChI=1S/C36H48N2O10/c1-6-37-17-33(18-48-31(41)19-9-7-8-10-22(19)38-25(39)11-12-26(38)40)14-13-24(45-3)35-21-15-20-23(44-2)16-34(42,27(21)28(20)46-4)36(43,32(35)37)30(47-5)29(33)35/h7-10,20-21,23-24,27-30,32,42-43H,6,11-18H2,1-5H3/t20-,21-,23+,24+,27-,28+,29-,30+,32+,33+,34-,35+,36-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C36H48N2O10
Molecular Weight	668.7737
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	11 / 13
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:05:07 GMT 2023` Edited by `admin` on `Sat Dec 16 08:05:07 GMT 2023`
Record UNII	T03UXI5O64
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

LYCACONITINE

Common Name

English

ACONITANE-7,8-DIOL, 4-(((2-(2,5-DIOXO-1-PYRROLIDINYL)BENZOYL)OXY)METHYL)-20-ETHYL-1,6,14,16-TETRAMETHOXY-, (1.ALPHA.,6.BETA.,14.ALPHA.,16.BETA.)-

Systematic Name

English

N-SUCCINYLANTHRANILIC ACID ESTER

Common Name

English

LYCOCTONINE LYCACONITINE [MI]

Common Name

English

Code System Code Type Description

FDA UNII

T03UXI5O64