AJACINE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C34H48N2O9
Molecular Weight	628.7529
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(NC(C)=O)C=CC=C7)(CC[C@@H]4OC)[C@@]5([H])[C@H](OC)[C@]6(O)[C@@]2(O)C[C@@H]3OC

InChI

InChIKey=NUXFDCYXMLVOFU-AYBRVATOSA-N

InChI=1S/C34H48N2O9/c1-7-36-16-31(17-45-29(38)19-10-8-9-11-22(19)35-18(2)37)13-12-24(42-4)33-21-14-20-23(41-3)15-32(39,25(21)26(20)43-5)34(40,30(33)36)28(44-6)27(31)33/h8-11,20-21,23-28,30,39-40H,7,12-17H2,1-6H3,(H,35,37)/t20-,21-,23+,24+,25-,26+,27-,28+,30+,31+,32-,33+,34-/m1/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

AJACINE

Common Name

English

N-(ACETYLANTHRANILOYL)LYCOCTONINE

Common Name

English

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

Systematic Name

English

PONTACONITINE A

Common Name

English

N-ACETYLANTHRANILIC ACID ESTER

Common Name

English

AJACINE [MI]

Common Name

English

Code System Code Type Description

FDA UNII

GP3SE3H2BB

Created by admin on Sat Dec 16 08:29:51 GMT 2023 , Edited by admin on Sat Dec 16 08:29:51 GMT 2023

PRIMARY

CAS

509-17-1

Created by admin on Sat Dec 16 08:29:51 GMT 2023 , Edited by admin on Sat Dec 16 08:29:51 GMT 2023

PRIMARY

PUBCHEM

101667972

Created by admin on Sat Dec 16 08:29:51 GMT 2023 , Edited by admin on Sat Dec 16 08:29:51 GMT 2023

PRIMARY

EPA CompTox

DTXSID80928950

Created by admin on Sat Dec 16 08:29:51 GMT 2023 , Edited by admin on Sat Dec 16 08:29:51 GMT 2023

PRIMARY

SUBSTANCE RECORD


					GP3SE3H2BB

AJACINE