(8S,10S)-8-(1,2-Dihydroxyethyl)-7,8,9,10-tetrahydro-6,8,10,11-tetrahydroxy-1-methoxy-5,12-naphthacenedione

Details

Stereochemistry	EPIMERIC
Molecular Formula	C21H20O9
Molecular Weight	416.3781
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of (8S,10S)-8-(1,2-Dihydroxyethyl)-7,8,9,10-tetrahydro-6,8,10,11-tetrahydroxy-1-methoxy-5,12-naphthacenedione

Structure Search

SMILES

COC1=C2C(=O)C3=C(O)C4=C(C[C@](O)(C[C@@H]4O)C(O)CO)C(O)=C3C(=O)C2=CC=C1

InChI

InChIKey=CGVVIRBOJFDFBH-PTIJRGHASA-N

InChI=1S/C21H20O9/c1-30-11-4-2-3-8-14(11)20(28)16-15(17(8)25)18(26)9-5-21(29,12(24)7-22)6-10(23)13(9)19(16)27/h2-4,10,12,22-24,26-27,29H,5-7H2,1H3/t10-,12?,21-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C21H20O9
Molecular Weight	416.3781
Charge	0
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	2 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 17:20:35 GMT 2025` Edited by `admin` on `Wed Apr 02 17:20:35 GMT 2025`
Record UNII	6DZM5MZD4B
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

5,12-Naphthacenedione, 8-(1,2-dihydroxyethyl)-7,8,9,10-tetrahydro-6,8,10,11-tetrahydroxy-1-methoxy-, (8S,10S)-

Preferred Name

English

(8S,10S)-8-(1,2-Dihydroxyethyl)-7,8,9,10-tetrahydro-6,8,10,11-tetrahydroxy-1-methoxy-5,12-naphthacenedione

Systematic Name

English

8-(1,2-Dihydroxyethyl)-7,8,9,10-tetrahydro-6,8,10,11-tetrahydroxy-1-methoxy-5,12-naphthacenedione, (8S,10S)-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID001110076

Created by admin on Wed Apr 02 17:20:35 GMT 2025 , Edited by admin on Wed Apr 02 17:20:35 GMT 2025

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PUBCHEM

10476988

Created by admin on Wed Apr 02 17:20:35 GMT 2025 , Edited by admin on Wed Apr 02 17:20:35 GMT 2025

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FDA UNII

6DZM5MZD4B

Created by admin on Wed Apr 02 17:20:35 GMT 2025 , Edited by admin on Wed Apr 02 17:20:35 GMT 2025

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CAS

210837-88-0

Created by admin on Wed Apr 02 17:20:35 GMT 2025 , Edited by admin on Wed Apr 02 17:20:35 GMT 2025

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