GITOGENIN DIACETATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C31H48O6
Molecular Weight	516.7092
Optical Activity	UNSPECIFIED
Defined Stereocenters	13 / 13
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@]12C[C@@]3([H])[C@]4([H])CC[C@@]5([H])C[C@@H](OC(C)=O)[C@@H](C[C@]5(C)[C@@]4([H])CC[C@]3(C)[C@@]1([H])[C@H](C)[C@@]6(CC[C@@H](C)CO6)O2)OC(C)=O

InChI

InChIKey=DKNKURXYEOJDRI-UHNDFYHCSA-N

InChI=1S/C31H48O6/c1-17-9-12-31(34-16-17)18(2)28-26(37-31)14-24-22-8-7-21-13-25(35-19(3)32)27(36-20(4)33)15-30(21,6)23(22)10-11-29(24,28)5/h17-18,21-28H,7-16H2,1-6H3/t17-,18+,21+,22-,23+,24+,25-,26+,27-,28+,29+,30+,31-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C31H48O6
Molecular Weight	516.7092
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	12 / 13
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:37:39 GMT 2023` Edited by `admin` on `Sat Dec 16 09:37:39 GMT 2023`
Record UNII	WP1666Z328
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

GITOGENIN DIACETATE

Common Name

English

5.ALPHA.-SPIROSTAN-2.ALPHA.,3.BETA.-DIOL, DIACETATE, (25R)-

Systematic Name

English

SPIROSTAN-2,3-DIOL, DIACETATE, (2.ALPHA.,3.BETA.,5.ALPHA.,25R)-

Systematic Name

English

GITOGENIN DIACETATE [MI]

Common Name

English

Code System Code Type Description

MERCK INDEX

m5736

Created by admin on Sat Dec 16 09:37:39 GMT 2023 , Edited by admin on Sat Dec 16 09:37:39 GMT 2023

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Merck Index

PUBCHEM

14104209

Created by admin on Sat Dec 16 09:37:39 GMT 2023 , Edited by admin on Sat Dec 16 09:37:39 GMT 2023

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FDA UNII

WP1666Z328

Created by admin on Sat Dec 16 09:37:39 GMT 2023 , Edited by admin on Sat Dec 16 09:37:39 GMT 2023

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CAS

3399-20-0

Created by admin on Sat Dec 16 09:37:39 GMT 2023 , Edited by admin on Sat Dec 16 09:37:39 GMT 2023

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