3,3-DICHLOROHEXAHYDRO-7,9B-DIMETHYL-1H-4,6,9A-(EPOXYMETHENO)-2-OXACYCLOOCTA(CD)PENTALENE-2A,4A,7(5H,9BH)-TRIOL, (2AR-(2A.BETA.,4.BETA.,4A.ALPHA.,6.BETA.,7.BETA.,9A.BETA.,9B.ALPHA.,10R*))-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C15H20Cl2O5
Molecular Weight	351.222
Optical Activity	UNSPECIFIED
Defined Stereocenters	8 / 8
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3,3-DICHLOROHEXAHYDRO-7,9B-DIMETHYL-1H-4,6,9A-(EPOXYMETHENO)-2-OXACYCLOOCTA(CD)PENTALENE-2A,4A,7(5H,9BH)-TRIOL, (2AR-(2A.BETA.,4.BETA.,4A.ALPHA.,6.BETA.,7.BETA.,9A.BETA.,9B.ALPHA.,10R*))-

Structure Search

SMILES

[H][C@]12O[C@]3([H])[C@@H]4C[C@]1(O)[C@@]5(C)[C@@]3(CO[C@@]5(O)C2(Cl)Cl)CC[C@@]4(C)O

InChI

InChIKey=QRAZVUKKKSJDNR-CYIQDBDSSA-N

InChI=1S/C15H20Cl2O5/c1-10(18)3-4-12-6-21-15(20)11(12,2)13(19)5-7(10)8(12)22-9(13)14(15,16)17/h7-9,18-20H,3-6H2,1-2H3/t7-,8+,9-,10+,11+,12+,13-,15+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C15H20Cl2O5
Molecular Weight	351.222
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	8 / 8
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 11:37:26 GMT 2023` Edited by `admin` on `Sat Dec 16 11:37:26 GMT 2023`
Record UNII	I38703UF1D
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3,3-DICHLOROHEXAHYDRO-7,9B-DIMETHYL-1H-4,6,9A-(EPOXYMETHENO)-2-OXACYCLOOCTA(CD)PENTALENE-2A,4A,7(5H,9BH)-TRIOL, (2AR-(2A.BETA.,4.BETA.,4A.ALPHA.,6.BETA.,7.BETA.,9A.BETA.,9B.ALPHA.,10R*))-

Common Name

English

1H-4,6,9A-(EPOXYMETHENO)-2-OXACYCLOOCTA(CD)PENTALENE-2A,4A,7(5H,9BH)-TRIOL, 3,3-DICHLOROHEXAHYDRO-7,9B-DIMETHYL-, (2AR-(2A.ALPHA.,4.BETA.,4A.ALPHA.,6.BETA.,7.BETA.,9A.BETA.,9B.ALPHA.,10R*))-

Systematic Name

English

1H-4,6,9A-(EPOXYMETHENO)-2-OXACYCLOOCTA(CD)PENTALENE-2A,4A,7(5H,9BH)-TRIOL, 3,3-DICHLOROHEXAHYDRO-7,9B-DIMETHYL-, (2AR-(2A.BETA.,4.BETA.,4A.ALPHA.,6.BETA.,7.BETA.,9.ABETA.,9B.ALPHA.,10R*))-

Systematic Name

English

Code System Code Type Description

CAS

101199-68-2

Created by admin on Sat Dec 16 11:37:26 GMT 2023 , Edited by admin on Sat Dec 16 11:37:26 GMT 2023

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FDA UNII

I38703UF1D

Created by admin on Sat Dec 16 11:37:26 GMT 2023 , Edited by admin on Sat Dec 16 11:37:26 GMT 2023

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PUBCHEM

119057999

Created by admin on Sat Dec 16 11:37:26 GMT 2023 , Edited by admin on Sat Dec 16 11:37:26 GMT 2023

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