13'-HYDROXYVERRUCARIN J

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C27H32O9
Molecular Weight	500.5376
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC1=C[C@H]2O[C@@H]3C[C@H]4OC(=O)\C=C\C=C\C(=O)OCCC(CO)=CC(=O)OC[C@@]2(CC1)[C@]4(C)[C@]35CO5

InChI

InChIKey=OQVXFAVSMVQTMH-ADXYGMRYSA-N

InChI=1S/C27H32O9/c1-17-7-9-26-15-33-24(31)12-18(14-28)8-10-32-22(29)5-3-4-6-23(30)36-19-13-21(35-20(26)11-17)27(16-34-27)25(19,26)2/h3-6,11-12,19-21,28H,7-10,13-16H2,1-2H3/b5-3+,6-4+,18-12+/t19-,20-,21-,25-,26-,27+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C27H32O9
Molecular Weight	500.5376
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	6 / 6
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 11:22:45 GMT 2025` Edited by `admin` on `Wed Apr 02 11:22:45 GMT 2025`
Record UNII	Z5VR19PDMO
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ANTIBIOTIC PD-113325

Preferred Name

English

13'-HYDROXYVERRUCARIN J

Common Name

English

(2'E)-2',3'-DIDEHYDRO-2'-DEOXY-13'-HYDROXYVERRUCARIN A

Common Name

English

VERRUCARIN A, 2',3'-DIDEHYDRO-2'-DEOXY-13'-HYDROXY-, (2'E)-

Common Name

English

PD-113,325

Code

English

J168.840E

Code

English

Code System Code Type Description

FDA UNII

Z5VR19PDMO

Created by admin on Wed Apr 02 11:22:45 GMT 2025 , Edited by admin on Wed Apr 02 11:22:45 GMT 2025

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CAS

90297-50-0

Created by admin on Wed Apr 02 11:22:45 GMT 2025 , Edited by admin on Wed Apr 02 11:22:45 GMT 2025

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PUBCHEM

91809636

Created by admin on Wed Apr 02 11:22:45 GMT 2025 , Edited by admin on Wed Apr 02 11:22:45 GMT 2025

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