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

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C16H22Cl2O5
Molecular Weight	365.249
Optical Activity	UNSPECIFIED
Defined Stereocenters	8 / 8
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

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

Structure Search

SMILES

CO[C@]1(C)CC[C@@]23CO[C@@]4(O)C(Cl)(Cl)[C@H]5O[C@@H]2[C@@H]1C[C@]5(O)[C@@]34C

InChI

InChIKey=CPXMLPQNXUWSDC-XOJHMPSOSA-N

InChI=1S/C16H22Cl2O5/c1-11(21-3)4-5-13-7-22-16(20)12(13,2)14(19)6-8(11)9(13)23-10(14)15(16,17)18/h8-10,19-20H,4-7H2,1-3H3/t8-,9+,10-,11+,12+,13+,14-,16+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C16H22Cl2O5
Molecular Weight	365.249
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 `Tue Apr 01 16:40:32 GMT 2025` Edited by `admin` on `Tue Apr 01 16:40:32 GMT 2025`
Record UNII	2H2FX0Z20Y
Record Status	`Validated (UNII)`
Record Version

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Type

Language

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

Preferred Name

English

Code System Code Type Description

FDA UNII

2H2FX0Z20Y

Created by admin on Tue Apr 01 16:40:32 GMT 2025 , Edited by admin on Tue Apr 01 16:40:32 GMT 2025

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CAS

101199-69-3

Created by admin on Tue Apr 01 16:40:32 GMT 2025 , Edited by admin on Tue Apr 01 16:40:32 GMT 2025

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PUBCHEM

119058000

Created by admin on Tue Apr 01 16:40:32 GMT 2025 , Edited by admin on Tue Apr 01 16:40:32 GMT 2025

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