INGENOL DISOXATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C28H37NO7
Molecular Weight	499.5959
Optical Activity	UNSPECIFIED
Defined Stereocenters	8 / 8
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12C[C@@H](C)[C@]34C=C(C)[C@H](OC(=O)C5=C(CC)ON=C5CC)[C@@]3(O)[C@H](O)C(CO)=C[C@]([H])(C4=O)[C@]1([H])C2(C)C

InChI

InChIKey=GLIUZQUNUNICGS-XUBYYPQFSA-N

InChI=1S/C28H37NO7/c1-7-18-20(19(8-2)36-29-18)25(33)35-24-13(3)11-27-14(4)9-17-21(26(17,5)6)16(23(27)32)10-15(12-30)22(31)28(24,27)34/h10-11,14,16-17,21-22,24,30-31,34H,7-9,12H2,1-6H3/t14-,16+,17-,21+,22-,24+,27+,28+/m1/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

INGENOL DISOXATE

Official Name

English

(1aR,2S,3Z,5R,5aS,6S,8aS,9R,10aR)-5,5a-Dihydroxy-4-(hydroxymethyl)-1,1,7,9-tetramethyl-11-oxo-1a,2,5,5a,6,9,10,10a-octahydro-1H-2,8a-methanocyclopenta[a]cyclpropa[E][10]annulen-6-yl 3,5-diethylisoxazole-4-carboxylate

Systematic Name

English

Ingenol disoxate [WHO-DD]

Common Name

English

LEO43204

Code

English

ingenol disoxate [INN]

Common Name

English

LEO-43204

Code

English

INGENOL DISOXATE [USAN]

Common Name

English

INGENOL 3-(3,5-DIETHYLISOXAZOLE-4-CARBOXYLATE)

Common Name

English

4-ISOXAZOLECARBOXYLIC ACID, 3,5-DIETHYL-, (1AR,2S,5R,5AS,6S,8AS,9R,10AR)-1A,2,5,5A,6,9,10,10A-OCTAHYDRO-5,5A-DIHYDROXY-4-(HYDROXYMETHYL)-1,1,7,9-TETRAMETHYL-11-OXO-1H-2,8A-METHANOCYCLOPENTA(A)CYCLOPROPA(E)CYCLODECEN-6-YL ESTER

Systematic Name

English

Code System Code Type Description

NCI_THESAURUS

C123379