AMAROLIDE 2-ACETATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C22H30O7
Molecular Weight	406.4694
Optical Activity	UNSPECIFIED
Defined Stereocenters	10 / 10
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@]12C[C@@]3([H])[C@H](C)C[C@H](OC(C)=O)C(=O)[C@]3(C)[C@@]4([H])[C@H](O)C(=O)[C@H](C)[C@]([H])(CC(=O)O1)[C@]24C

InChI

InChIKey=YOYADNDGFPEXPI-WGRRCHGUSA-N

InChI=1S/C22H30O7/c1-9-6-14(28-11(3)23)20(27)22(5)12(9)7-15-21(4)13(8-16(24)29-15)10(2)17(25)18(26)19(21)22/h9-10,12-15,18-19,26H,6-8H2,1-5H3/t9-,10-,12+,13+,14+,15-,18-,19+,21-,22+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C22H30O7
Molecular Weight	406.4694
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	9 / 10
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:06:09 GMT 2023` Edited by `admin` on `Sat Dec 16 09:06:09 GMT 2023`
Record UNII	38637N559X
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

AMAROLIDE 2-ACETATE

Common Name

English

PHENANTHRO(10,1-BC)PYRAN-2,5,11(1H,3H,4H)-TRIONE, 3A.ALPHA.,6A.ALPHA.,7,7A.BETA.,8,9,10,11A,11B.BETA.,11C-DECAHYDRO-1.BETA.,10.BETA.-DIHYDROXY-3.BETA.,8.BETA.,11A.ALPHA.,11C.ALPHA.-TETRAMETHYL-, 10-ACETATE

Systematic Name

English

PICRASANE-1,12,16-TRIONE, 2-(ACETYLOXY)-11-HYDROXY-, (2.ALPHA.,11.ALPHA.)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

72710706

Created by admin on Sat Dec 16 09:06:09 GMT 2023 , Edited by admin on Sat Dec 16 09:06:09 GMT 2023

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CAS

29913-89-1

Created by admin on Sat Dec 16 09:06:09 GMT 2023 , Edited by admin on Sat Dec 16 09:06:09 GMT 2023

PRIMARY

FDA UNII

38637N559X

Created by admin on Sat Dec 16 09:06:09 GMT 2023 , Edited by admin on Sat Dec 16 09:06:09 GMT 2023

PRIMARY