AKLAVINONE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C22H20O8
Molecular Weight	412.3894
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC[C@@]1(O)C[C@H](O)C2=C(O)C3=C(C=C2[C@H]1C(=O)OC)C(=O)C4=CC=CC(O)=C4C3=O

InChI

InChIKey=RACGRCLGVYXIAO-YOKWENHESA-N

InChI=1S/C22H20O8/c1-3-22(29)8-13(24)15-10(17(22)21(28)30-2)7-11-16(20(15)27)19(26)14-9(18(11)25)5-4-6-12(14)23/h4-7,13,17,23-24,27,29H,3,8H2,1-2H3/t13-,17-,22+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C22H20O8
Molecular Weight	412.3894
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:04:57 GMT 2023` Edited by `admin` on `Sat Dec 16 08:04:57 GMT 2023`
Record UNII	J8NH9FR49N
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

AKLAVINONE

Common Name

English

NSC-114780

Code

English

1-NAPHTHACENECARBOXYLIC ACID, 2-ETHYL-1,2,3,4,6,11-HEXAHYDRO-2,4,5,7-TETRAHYDROXY-6,11-DIOXO-, METHYL ESTER, (1R,2R,4S)-

Systematic Name

English

METHYL (1R,2R,4S)-2-ETHYL-1,2,3,4,6,11-HEXAHYDRO-2,4,5,7-TETRAHYDROXY-6,11-DIOXO-1-NAPHTHACENECARBOXYLATE

Systematic Name

English

ANTIBIOTIC MA 144D1

Common Name

English

Code System Code Type Description

FDA UNII

J8NH9FR49N