COAGULIN Q

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C34H52O10
Molecular Weight	620.7707
Optical Activity	( + )
Defined Stereocenters	15 / 15
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12CC[C@]([H])([C@@](C)(O)[C@@]3([H])CC(C)=C(C)C(=O)O3)[C@@]1(C)CC[C@@]4([H])[C@@]2([H])CCC5=C[C@H](C[C@H](O)[C@]45C)O[C@]6([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O

InChI

InChIKey=RTAGBZHBBMSCPX-PUBYPCKASA-N

InChI=1S/C34H52O10/c1-16-12-26(44-30(40)17(16)2)34(5,41)24-9-8-21-20-7-6-18-13-19(42-31-29(39)28(38)27(37)23(15-35)43-31)14-25(36)33(18,4)22(20)10-11-32(21,24)3/h13,19-29,31,35-39,41H,6-12,14-15H2,1-5H3/t19-,20+,21+,22+,23-,24+,25+,26-,27-,28+,29-,31-,32+,33+,34-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C34H52O10
Molecular Weight	620.7707
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	15 / 15
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 10:07:15 GMT 2023` Edited by `admin` on `Sat Dec 16 10:07:15 GMT 2023`
Record UNII	MX8C587WWF
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

COAGULIN Q

Common Name

English

ERGOSTA-4,24-DIEN-26-OIC ACID, 3-(.BETA.-D-GLUCOPYRANOSYLOXY)-1,20,22-TRIHYDROXY-, .DELTA.-LACTONE, (1.ALPHA.,3.BETA.,22R)-

Systematic Name

English

(+)-COAGULIN Q

Common Name

English

Code System Code Type Description

PUBCHEM

162623730

Created by admin on Sat Dec 16 10:07:15 GMT 2023 , Edited by admin on Sat Dec 16 10:07:15 GMT 2023

PRIMARY

CAS

261637-26-7

Created by admin on Sat Dec 16 10:07:15 GMT 2023 , Edited by admin on Sat Dec 16 10:07:15 GMT 2023

PRIMARY

FDA UNII

MX8C587WWF

Created by admin on Sat Dec 16 10:07:15 GMT 2023 , Edited by admin on Sat Dec 16 10:07:15 GMT 2023

PRIMARY

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