GENTROGENIN ACETATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C29H42O5
Molecular Weight	470.6408
Optical Activity	UNSPECIFIED
Defined Stereocenters	11 / 11
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@]12C[C@@]3([H])[C@]4([H])CC=C5C[C@H](CC[C@]5(C)[C@@]4([H])CC(=O)[C@]3(C)[C@@]1([H])[C@H](C)[C@@]6(CC[C@@H](C)CO6)O2)OC(C)=O

InChI

InChIKey=MSNYSLBOIHUYMS-URBKRRPPSA-N

InChI=1S/C29H42O5/c1-16-8-11-29(32-15-16)17(2)26-24(34-29)13-23-21-7-6-19-12-20(33-18(3)30)9-10-27(19,4)22(21)14-25(31)28(23,26)5/h6,16-17,20-24,26H,7-15H2,1-5H3/t16-,17+,20+,21-,22+,23+,24+,26+,27+,28-,29-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C29H42O5
Molecular Weight	470.6408
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	10 / 11
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 10:01:17 GMT 2023` Edited by `admin` on `Sat Dec 16 10:01:17 GMT 2023`
Record UNII	B94OAH0QXQ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

GENTROGENIN ACETATE

Common Name

English

BOTOGENIN, ACETATE

Common Name

English

SPIROST-5-EN-12-ONE, 3-(ACETYLOXY)-, (3.BETA.,25R)-

Systematic Name

English

GENTROGENIN ACETATE [MI]

Common Name

English

Code System Code Type Description

FDA UNII

B94OAH0QXQ

Created by admin on Sat Dec 16 10:01:17 GMT 2023 , Edited by admin on Sat Dec 16 10:01:17 GMT 2023

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MERCK INDEX

m200

Created by admin on Sat Dec 16 10:01:17 GMT 2023 , Edited by admin on Sat Dec 16 10:01:17 GMT 2023

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Merck Index

CAS

5996-01-0

Created by admin on Sat Dec 16 10:01:17 GMT 2023 , Edited by admin on Sat Dec 16 10:01:17 GMT 2023

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PUBCHEM

86278160

Created by admin on Sat Dec 16 10:01:17 GMT 2023 , Edited by admin on Sat Dec 16 10:01:17 GMT 2023

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