HOLARRHENINE ACETATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C26H42N2O2
Molecular Weight	414.6239
Optical Activity	UNSPECIFIED
Defined Stereocenters	9 / 9
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@]12CC[C@@]3([H])[C@]4([H])CC=C5C[C@H](CC[C@]5(C)[C@@]4([H])C[C@@H](OC(C)=O)[C@]13CN(C)[C@H]2C)N(C)C

InChI

InChIKey=CWTSHGMPMNOYPP-QHDJFITCSA-N

InChI=1S/C26H42N2O2/c1-16-21-9-10-22-20-8-7-18-13-19(27(4)5)11-12-25(18,3)23(20)14-24(30-17(2)29)26(21,22)15-28(16)6/h7,16,19-24H,8-15H2,1-6H3/t16-,19-,20-,21+,22-,23-,24+,25-,26+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C26H42N2O2
Molecular Weight	414.6239
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	9 / 9
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:13:26 GMT 2023` Edited by `admin` on `Sat Dec 16 09:13:26 GMT 2023`
Record UNII	403KVU8COO
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

HOLARRHENINE ACETATE

Common Name

English

O-ACETYLHOLARRHENINE [MI]

Common Name

English

O-ACETYL-(3.BETA.,12.BETA.)-3-(DIMETHYLAMINO)CON-5-ENIN-12-OL

Systematic Name

English

O-ACETYLHOLARRHENINE

Common Name

English

Code System Code Type Description

PUBCHEM

90478623

Created by admin on Sat Dec 16 09:13:26 GMT 2023 , Edited by admin on Sat Dec 16 09:13:26 GMT 2023

PRIMARY

FDA UNII

403KVU8COO

Created by admin on Sat Dec 16 09:13:26 GMT 2023 , Edited by admin on Sat Dec 16 09:13:26 GMT 2023

PRIMARY

CAS

106422-91-7

Created by admin on Sat Dec 16 09:13:26 GMT 2023 , Edited by admin on Sat Dec 16 09:13:26 GMT 2023

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