7,10-Dimethoxy-10-DAB III

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C31H40O10
Molecular Weight	572.6433
Optical Activity	UNSPECIFIED
Defined Stereocenters	9 / 9
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CO[C@H]1C[C@H]2OC[C@@]2(OC(C)=O)[C@H]3[C@H](OC(=O)C4=CC=CC=C4)[C@]5(O)C[C@H](O)C(C)=C([C@@H](OC)C(=O)[C@]13C)C5(C)C

InChI

InChIKey=MGJMLMORVVDLIU-VHLOTGQHSA-N

InChI=1S/C31H40O10/c1-16-19(33)14-31(36)26(40-27(35)18-11-9-8-10-12-18)24-29(5,25(34)23(38-7)22(16)28(31,3)4)20(37-6)13-21-30(24,15-39-21)41-17(2)32/h8-12,19-21,23-24,26,33,36H,13-15H2,1-7H3/t19-,20-,21+,23+,24-,26-,29+,30-,31+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C31H40O10
Molecular Weight	572.6433
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 17:23:31 GMT 2025` Edited by `admin` on `Wed Apr 02 17:23:31 GMT 2025`
Record UNII	YCE743S7EF
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

7,10-Dimethoxy-10-DAB III

Common Name

English

10-Deacetyl-7,10-dimethylbaccatin III

Preferred Name

English

7,11-Methano-5H-cyclodeca[3,4]benz[1,2-b]oxet-5-one, 12b-(acetyloxy)-12-(benzoyloxy)-1,2a,3,4,4a,6,9,10,11,12,12a,12b-dodecahydro-9,11-dihydroxy-4,6-dimethoxy-4a,8,13,13-tetramethyl-, (2aR,4S,4aS,6R,9S,11S,12S,12aR,12bS)-

Systematic Name

English

(2aR,4S,4aS,6R,9S,11S,12S,12aR,12bS)-12b-(Acetyloxy)-12-(benzoyloxy)-1,2a,3,4,4a,6,9,10,11,12,12a,12b-dodecahydro-9,11-dihydroxy-4,6-dimethoxy-4a,8,13,13-tetramethyl-7,11-methano-5H-cyclodeca[3,4]benz[1,2-b]oxet-5-one

Systematic Name

English

7,11-Methano-5H-cyclodeca[3,4]benz[1,2-b]oxet-5-one, 12b-(acetyloxy)-12-(benzoyloxy)-1,2a,3,4,4a,6,9,10,11,12,12a,12b-dodecahydro-9,11-dihydroxy-4,6-dimethoxy-4a,8,13,13-tetramethyl-, [2aR-(2a?,4?,4a?,6?,9?,11?,12?,12a?,12b?)]-

Systematic Name

English

7?,10?-Dimethoxy-10-deacetylbaccatin III

Common Name

English

10-Deacetylbaccatin III 7,10-dimethyl ether

Common Name

English

7,10-Dimethoxy-10-deacetylbaccatin III

Common Name

English

4?-Acetoxy-2?-benzoyloxy-5?,20-epoxy-1?,13?-dihydroxy-7?,10?-dimethoxy-9-oxo-11-taxene

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID301098192

Created by admin on Wed Apr 02 17:23:31 GMT 2025 , Edited by admin on Wed Apr 02 17:23:31 GMT 2025

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FDA UNII

YCE743S7EF

Created by admin on Wed Apr 02 17:23:31 GMT 2025 , Edited by admin on Wed Apr 02 17:23:31 GMT 2025

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PUBCHEM

9916108

Created by admin on Wed Apr 02 17:23:31 GMT 2025 , Edited by admin on Wed Apr 02 17:23:31 GMT 2025

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CAS

183133-94-0

Created by admin on Wed Apr 02 17:23:31 GMT 2025 , Edited by admin on Wed Apr 02 17:23:31 GMT 2025

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