VA-045

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C22H25N3O5
Molecular Weight	411.451
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC[C@@]12CCC[N@]3CCC4=C([C@H]13)N(C5=CC=CC=C45)C(=C2)C(=O)OCCO[N+]([O-])=O

InChI

InChIKey=VDHLDQHKSSLLJV-IRLDBZIGSA-N

InChI=1S/C22H25N3O5/c1-2-22-9-5-10-23-11-8-16-15-6-3-4-7-17(15)24(19(16)20(22)23)18(14-22)21(26)29-12-13-30-25(27)28/h3-4,6-7,14,20H,2,5,8-13H2,1H3/t20-,22+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C22H25N3O5
Molecular Weight	411.451
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 16:35:07 GMT 2023` Edited by `admin` on `Sat Dec 16 16:35:07 GMT 2023`
Record UNII	SB33D27EMV
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

VA-045

Common Name

English

2-(NITROOXY)ETHYL APOVINCAMINATE

Common Name

English

2-NITROOXYETHYL (15S,19R)-15-ETHYL-1,11-DIAZAPENTACYCLO(9.6.2.02,7.08,18.015,19)NONADECA-2,4,6,8(18),16-PENTAENE-17-CARBOXYLATE

Systematic Name

English

EBURNAMENINE-14-CARBOXYLIC ACID, 2-(NITROOXY)ETHYL ESTER, (3.ALPHA.,16.ALPHA.)-

Common Name

English

Code System Code Type Description

FDA UNII

SB33D27EMV

Created by admin on Sat Dec 16 16:35:07 GMT 2023 , Edited by admin on Sat Dec 16 16:35:07 GMT 2023

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EPA CompTox

DTXSID30926209

Created by admin on Sat Dec 16 16:35:07 GMT 2023 , Edited by admin on Sat Dec 16 16:35:07 GMT 2023

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CAS

128759-76-2

Created by admin on Sat Dec 16 16:35:07 GMT 2023 , Edited by admin on Sat Dec 16 16:35:07 GMT 2023

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PUBCHEM

164258

Created by admin on Sat Dec 16 16:35:07 GMT 2023 , Edited by admin on Sat Dec 16 16:35:07 GMT 2023

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