VALLESINE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H28N2O2
Molecular Weight	340.4592
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC[C@@]12CCCN3CC[C@@]4([C@@H](CC1)N(C=O)C5=C4C=CC=C5OC)[C@@H]23

InChI

InChIKey=KYRQTZSLJBESSD-CWJKEVGVSA-N

InChI=1S/C21H28N2O2/c1-3-20-9-5-12-22-13-11-21(19(20)22)15-6-4-7-16(25-2)18(15)23(14-24)17(21)8-10-20/h4,6-7,14,17,19H,3,5,8-13H2,1-2H3/t17-,19-,20-,21-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C21H28N2O2
Molecular Weight	340.4592
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 23:33:27 GMT 2025` Edited by `admin` on `Mon Mar 31 23:33:27 GMT 2025`
Record UNII	53OB0BOS97
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

N-FORMYL-N-DEACETYLASPIDOSPERMINE

Preferred Name

English

VALLESINE

Common Name

English

N-FORMYL-N-DEACETYLASPIDOSPERMINE [MI]

Common Name

English

ASPIDOSPERMIDINE-1-CARBOXALDEHYDE, 17-METHOXY-

Common Name

English

N-DEACETYL-N-FORMYLASPIDOSPERMINE

Common Name

English

Code System Code Type Description

PUBCHEM

20054841

Created by admin on Mon Mar 31 23:33:27 GMT 2025 , Edited by admin on Mon Mar 31 23:33:27 GMT 2025

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FDA UNII

53OB0BOS97

Created by admin on Mon Mar 31 23:33:27 GMT 2025 , Edited by admin on Mon Mar 31 23:33:27 GMT 2025

PRIMARY

CAS

466-46-6

Created by admin on Mon Mar 31 23:33:27 GMT 2025 , Edited by admin on Mon Mar 31 23:33:27 GMT 2025

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EPA CompTox

DTXSID10196882

Created by admin on Mon Mar 31 23:33:27 GMT 2025 , Edited by admin on Mon Mar 31 23:33:27 GMT 2025

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