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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H22N2O2
Molecular Weight 322.4009
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of APOVINCAMINIC ACID

SMILES

[H][C@]12N3CCC[C@@]1(CC)C=C(N4C5=C(C=CC=C5)C(CC3)=C24)C(O)=O

InChI

InChIKey=ZFCQLDAGNBFMJQ-QUCCMNQESA-N
InChI=1S/C20H22N2O2/c1-2-20-9-5-10-21-11-8-14-13-6-3-4-7-15(13)22(17(14)18(20)21)16(12-20)19(23)24/h3-4,6-7,12,18H,2,5,8-11H2,1H3,(H,23,24)/t18-,20+/m1/s1

HIDE SMILES / InChI

Molecular Formula C20H22N2O2
Molecular Weight 322.4009
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 18:55:09 GMT 2023
Edited
by admin
on Sat Dec 16 18:55:09 GMT 2023
Record UNII
ZD6ZF4C86Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
APOVINCAMINIC ACID
Common Name English
(3.ALPHA.,16.ALPHA.)-EBURNAMENINE-14-CARBOXYLIC ACID
Common Name English
APOVINCAMIN-22-OIC ACID
Common Name English
(+)-APOVINCAMINIC ACID
Common Name English
CIS-APOVINCAMINIC ACID
Common Name English
1H-INDOLO(3,2,1-DE)PYRIDO(3,2,1-IJ)(1,5)NAPHTHYRIDINE-12-CARBOXYLIC ACID, 13.ALPHA.-ETHYL-2,3,5,6,13.ALPHA.,13.BETA.-HEXAHYDRO-, (13.ALPHA.S,13.BETA.S)-
Common Name English
(13.ALPHA.S,13.BETA.S)-13.ALPHA.-ETHYL-2,3,5,6,13.ALPHA.,13.BETA.-HEXAHYDRO-1H-INDOLO(3,2,1-DE)PYRIDO(3,2,1-IJ)(1,5)NAPHTHYRIDINE-12-CARBOXYLIC ACID
Common Name English
EBURNAMENINE-14-CARBOXYLIC ACID, (3.ALPHA.,16.ALPHA.)-
Common Name English
(+)-CIS-APOVINCAMINIC ACID
Common Name English
APOVINCAMINE, DERIVATIVE OF
Common Name English
Code System Code Type Description
ECHA (EC/EINECS)
248-651-1
Created by admin on Sat Dec 16 18:55:09 GMT 2023 , Edited by admin on Sat Dec 16 18:55:09 GMT 2023
PRIMARY
CAS
27773-65-5
Created by admin on Sat Dec 16 18:55:09 GMT 2023 , Edited by admin on Sat Dec 16 18:55:09 GMT 2023
PRIMARY
EPA CompTox
DTXSID80950458
Created by admin on Sat Dec 16 18:55:09 GMT 2023 , Edited by admin on Sat Dec 16 18:55:09 GMT 2023
PRIMARY
FDA UNII
ZD6ZF4C86Q
Created by admin on Sat Dec 16 18:55:09 GMT 2023 , Edited by admin on Sat Dec 16 18:55:09 GMT 2023
PRIMARY
PUBCHEM
160154
Created by admin on Sat Dec 16 18:55:09 GMT 2023 , Edited by admin on Sat Dec 16 18:55:09 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE ACTIVE