2,13-DIHYDROXY-3,11-EPOXYAPOTRICHOTHEC-9-ENE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C19H28O6
Molecular Weight	352.422
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2,13-DIHYDROXY-3,11-EPOXYAPOTRICHOTHEC-9-ENE

Structure Search

SMILES

[H][C@@]12O[C@]3(COC(C)=O)[C@@H](CC[C@]3(C)[C@@]1(C)C[C@H](O)C(C)=C2)OC(C)=O

InChI

InChIKey=MELIPHIFWPWUDX-XNIJUTNWSA-N

InChI=1S/C19H28O6/c1-11-8-16-17(4,9-14(11)22)18(5)7-6-15(24-13(3)21)19(18,25-16)10-23-12(2)20/h8,14-16,22H,6-7,9-10H2,1-5H3/t14-,15+,16-,17-,18+,19+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C19H28O6
Molecular Weight	352.422
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	6 / 6
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 10:40:09 GMT 2023` Edited by `admin` on `Sat Dec 16 10:40:09 GMT 2023`
Record UNII	9A0882LAUQ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2,13-DIHYDROXY-3,11-EPOXYAPOTRICHOTHEC-9-ENE

Common Name

English

2,13-DI-HYDROXY-3,11-EPOXYAPOTRICHOTHEC-9-ENE

Common Name

English

(3R-(3.ALPHA.,3A.BETA.,4A.BETA.,7.ALPHA.,8A.ALPHA.,8B.BETA.))- ((3R,3AR,4AS,7S,8AR,8BR)-3-ACETOXY-7-HYDROXY-6,8A,8B-TRIMETHYL-1,2,3,4A,7,8-HEXAHYDROCYCLOPENTA(B)BENZOFURAN-3A-YL)METHYL ACETATE

Systematic Name

English

1H-CYCLOPENTA(B)BENZOFURAN-3,7-DIOL, 3A-((ACETYLOXY)METHYL)-2,3,3A,4A,7,8,8A,8B-OCTAHYDRO-6,8,8A,8B-TRIMETHYL-, 3-ACETATE,

Systematic Name

English

Code System Code Type Description

PUBCHEM

21725818

Created by admin on Sat Dec 16 10:40:09 GMT 2023 , Edited by admin on Sat Dec 16 10:40:09 GMT 2023

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CAS

124028-47-3

Created by admin on Sat Dec 16 10:40:09 GMT 2023 , Edited by admin on Sat Dec 16 10:40:09 GMT 2023

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FDA UNII

9A0882LAUQ

Created by admin on Sat Dec 16 10:40:09 GMT 2023 , Edited by admin on Sat Dec 16 10:40:09 GMT 2023

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