ChemicalBook >> CAS DataBase List >>(3R,3'R,4S,4'S,4aS,4'aS)-2,2',3,3',4,4',9,9'-Octahydro-1,1',4,4',8,8'-hexahydroxy-3,3'-dimethyl-9,9'-dioxo-7,7'-bi(4aH-xanthene)-4a,4'a-dicarboxylic acid dimethyl ester

(3R,3'R,4S,4'S,4aS,4'aS)-2,2',3,3',4,4',9,9'-Octahydro-1,1',4,4',8,8'-hexahydroxy-3,3'-dimethyl-9,9'-dioxo-7,7'-bi(4aH-xanthene)-4a,4'a-dicarboxylic acid dimethyl ester

CAS No.
35287-72-0
Chemical Name:
(3R,3'R,4S,4'S,4aS,4'aS)-2,2',3,3',4,4',9,9'-Octahydro-1,1',4,4',8,8'-hexahydroxy-3,3'-dimethyl-9,9'-dioxo-7,7'-bi(4aH-xanthene)-4a,4'a-dicarboxylic acid dimethyl ester
Synonyms
Entothein;Ergochrome AA;Secalonic acid A;Ergochrome AA(2,2');(3R,3'R,4'S,4'aS)-2,2',3,3',4,4',9,9'-Octahydro-1,1',4α,4',8,8'-hexahydroxy-3β,3'-dimethyl-9,9'-dioxo-7,7'-bi[4aH-xanthene]-4aα,4a'-dicarboxylic acid dimethyl ester;(3R,3'R,4S,4'S,4aS,4'aS)-2,2',3,3',4,4',9,9'-Octahydro-1,1',4,4',8,8'-hexahydroxy-3,3'-dimethyl-9,9'-dioxo-7,7'-bi(4aH-xanthene)-4a,4'a-dicarboxylic acid dimethyl ester;[7,7'-Bi-4aH-xanthene]-4a,4'a-dicarboxylic acid, 2,2',3,3',4,4',9,9'-octahydro-1,1',4,4',8,8'-hexahydroxy-3,3'-dimethyl-9,9'-dioxo-, 4a,4'a-dimethyl ester, (3R,3'R,4S,4'S,4aS,4'aS)-
CBNumber:
CB92405620
Molecular Formula:
C32H30O14
Molecular Weight:
638.58
MDL Number:
MOL File:
35287-72-0.mol
Last updated:2023-05-04 17:34:38

(3R,3'R,4S,4'S,4aS,4'aS)-2,2',3,3',4,4',9,9'-Octahydro-1,1',4,4',8,8'-hexahydroxy-3,3'-dimethyl-9,9'-dioxo-7,7'-bi(4aH-xanthene)-4a,4'a-dicarboxylic acid dimethyl ester Properties

Melting point 246-248° (dec); mp 260° (Yoshioka et al., loc. cit.)
alpha D -73° (CHCl3)
Boiling point 869.3±65.0 °C(Predicted)
Density 1.67±0.1 g/cm3(Predicted)
pka pKDMF 8.7(at 25℃)
FDA UNII PFL7XJ35SC

(3R,3'R,4S,4'S,4aS,4'aS)-2,2',3,3',4,4',9,9'-Octahydro-1,1',4,4',8,8'-hexahydroxy-3,3'-dimethyl-9,9'-dioxo-7,7'-bi(4aH-xanthene)-4a,4'a-dicarboxylic acid dimethyl ester price

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
American Custom Chemicals Corporation DYE0003073 SECALONIC ACID A 95.00% 35287-72-0 5MG $496.02 2021-12-16 Buy
Product number Packaging Price Buy
DYE0003073 5MG $496.02 Buy

(3R,3'R,4S,4'S,4aS,4'aS)-2,2',3,3',4,4',9,9'-Octahydro-1,1',4,4',8,8'-hexahydroxy-3,3'-dimethyl-9,9'-dioxo-7,7'-bi(4aH-xanthene)-4a,4'a-dicarboxylic acid dimethyl ester Chemical Properties,Uses,Production

Definition

ChEBI: Secalonic acid A is a member of xanthenes.

(3R,3'R,4S,4'S,4aS,4'aS)-2,2',3,3',4,4',9,9'-Octahydro-1,1',4,4',8,8'-hexahydroxy-3,3'-dimethyl-9,9'-dioxo-7,7'-bi(4aH-xanthene)-4a,4'a-dicarboxylic acid dimethyl ester Preparation Products And Raw materials

Raw materials

Preparation Products

(3R,3'R,4S,4'S,4aS,4'aS)-2,2',3,3',4,4',9,9'-Octahydro-1,1',4,4',8,8'-hexahydroxy-3,3'-dimethyl-9,9'-dioxo-7,7'-bi(4aH-xanthene)-4a,4'a-dicarboxylic acid dimethyl ester Suppliers

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Supplier Tel Email Country ProdList Advantage
BOC Sciences 1-631-485-4226; 16314854226 info@bocsci.com United States 14059 65
Supplier Advantage
BOC Sciences 65
(3R,3'R,4'S,4'aS)-2,2',3,3',4,4',9,9'-Octahydro-1,1',4α,4',8,8'-hexahydroxy-3β,3'-dimethyl-9,9'-dioxo-7,7'-bi[4aH-xanthene]-4aα,4a'-dicarboxylic acid dimethyl ester (3R,3'R,4S,4'S,4aS,4'aS)-2,2',3,3',4,4',9,9'-Octahydro-1,1',4,4',8,8'-hexahydroxy-3,3'-dimethyl-9,9'-dioxo-7,7'-bi(4aH-xanthene)-4a,4'a-dicarboxylic acid dimethyl ester Entothein Ergochrome AA Ergochrome AA(2,2') Secalonic acid A [7,7'-Bi-4aH-xanthene]-4a,4'a-dicarboxylic acid, 2,2',3,3',4,4',9,9'-octahydro-1,1',4,4',8,8'-hexahydroxy-3,3'-dimethyl-9,9'-dioxo-, 4a,4'a-dimethyl ester, (3R,3'R,4S,4'S,4aS,4'aS)- 35287-72-0