ALLO-.BETA.-CORTOL

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H36O5
Molecular Weight	368.5075
Optical Activity	UNSPECIFIED
Defined Stereocenters	10 / 10
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12CC[C@](O)([C@H](O)CO)[C@@]1(C)C[C@H](O)[C@@]3([H])[C@@]2([H])CC[C@@]4([H])C[C@@H](O)CC[C@]34C

InChI

InChIKey=FFPUNPBUZDTHJI-ISKWUEMLSA-N

InChI=1S/C21H36O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h12-18,22-26H,3-11H2,1-2H3/t12-,13-,14-,15-,16-,17+,18+,19-,20-,21-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C21H36O5
Molecular Weight	368.5075
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	9 / 10
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 19:04:13 GMT 2023` Edited by `admin` on `Sat Dec 16 19:04:13 GMT 2023`
Record UNII	W484NMM80F
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ALLO-.BETA.-CORTOL

Common Name

English

ALLOPREGNANE-3.BETA.,11.BETA.,17.ALPHA.,20.BETA.,21-PENTOL [MI]

Common Name

English

KENDALL'S COMPOUND D

Common Name

English

REICHSTEIN'S SUBSTANCE A

Common Name

English

PREGNANE-3,11,17,20,21-PENTOL, (3.BETA.,5.ALPHA.,11.BETA.,20R)-

Systematic Name

English

ALLOPREGNANE-3.BETA.,11.BETA.,17.ALPHA.,20.BETA.,21-PENTOL

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID80993663