3,6-DI-O-METHYL-.BETA.-CYCLODEXTRIN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C56H98O35
Molecular Weight	1331.3563
Optical Activity	UNSPECIFIED
Defined Stereocenters	35 / 35
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3,6-DI-O-METHYL-.BETA.-CYCLODEXTRIN

Structure Search

SMILES

[H][C@@]12O[C@H](COC)[C@@]([H])(O[C@@]3([H])O[C@H](COC)[C@@]([H])(O[C@@]4([H])O[C@H](COC)[C@@]([H])(O[C@@]5([H])O[C@H](COC)[C@@]([H])(O[C@@]6([H])O[C@H](COC)[C@@]([H])(O[C@@]7([H])O[C@H](COC)[C@@]([H])(O[C@@]8([H])O[C@H](COC)[C@@]([H])(O1)[C@H](OC)[C@H]8O)[C@H](OC)[C@H]7O)[C@H](OC)[C@H]6O)[C@H](OC)[C@H]5O)[C@H](OC)[C@H]4O)[C@H](OC)[C@H]3O)[C@H](OC)[C@H]2O

InChI

InChIKey=VTLMEPDCCLBSJF-DXCNPSTGSA-N

InChI=1S/C56H98O35/c1-64-15-22-36-43(71-8)29(57)50(78-22)86-37-23(16-65-2)80-52(31(59)45(37)73-10)88-39-25(18-67-4)82-54(33(61)47(39)75-12)90-41-27(20-69-6)84-56(35(63)49(41)77-14)91-42-28(21-70-7)83-55(34(62)48(42)76-13)89-40-26(19-68-5)81-53(32(60)46(40)74-11)87-38-24(17-66-3)79-51(85-36)30(58)44(38)72-9/h22-63H,15-21H2,1-14H3/t22-,23-,24-,25-,26-,27-,28-,29-,30-,31-,32-,33-,34-,35-,36-,37-,38-,39-,40-,41-,42-,43-,44-,45-,46-,47-,48-,49-,50-,51-,52-,53-,54-,55-,56-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C56H98O35
Molecular Weight	1331.3563
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	35 / 35
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 11:17:52 GMT 2023` Edited by `admin` on `Sat Dec 16 11:17:52 GMT 2023`
Record UNII	QHN07C46M9
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

3,6-DI-O-METHYL-.BETA.-CYCLODEXTRIN

Common Name

English

.BETA.-CYCLODEXTRIN, 3A,3B,3C,3D,3E,3F,3G,6A,6B,6C,6D,6E,6F,6G-TETRADECA-O-METHYL-

Systematic Name

English

HEPTAKIS(3,6-DI-O-METHYL)-.BETA.-CYCLODEXTRIN

Common Name

English

Code System Code Type Description

PUBCHEM

14376899

Created by admin on Sat Dec 16 11:17:52 GMT 2023 , Edited by admin on Sat Dec 16 11:17:52 GMT 2023

PRIMARY

CAS

123155-22-6

Created by admin on Sat Dec 16 11:17:52 GMT 2023 , Edited by admin on Sat Dec 16 11:17:52 GMT 2023

PRIMARY

FDA UNII

QHN07C46M9

Created by admin on Sat Dec 16 11:17:52 GMT 2023 , Edited by admin on Sat Dec 16 11:17:52 GMT 2023

PRIMARY