SCILLIPHAEOSIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C30H42O9
Molecular Weight	546.6491
Optical Activity	UNSPECIFIED
Defined Stereocenters	13 / 13
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]6(O[C@H]1CC[C@@]2(C)C(CC[C@]3([H])[C@]2([H])C[C@@H](O)[C@]4(C)[C@H](CC[C@]34O)C5=COC(=O)C=C5)=C1)O[C@@H](C)[C@H](O)[C@@H](O)[C@H]6O

InChI

InChIKey=ZBAPFMPUNXTWQQ-PVLLBMPJSA-N

InChI=1S/C30H42O9/c1-15-24(33)25(34)26(35)27(38-15)39-18-8-10-28(2)17(12-18)5-6-20-21(28)13-22(31)29(3)19(9-11-30(20,29)36)16-4-7-23(32)37-14-16/h4,7,12,14-15,18-22,24-27,31,33-36H,5-6,8-11,13H2,1-3H3/t15-,18-,19+,20+,21-,22+,24-,25+,26+,27-,28-,29-,30-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C30H42O9
Molecular Weight	546.6491
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:25:17 GMT 2023` Edited by `admin` on `Sat Dec 16 08:25:17 GMT 2023`
Record UNII	1RD23DNN41
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SCILLIPHAEOSIDE

Common Name

English

SCILLIPHAOSIDE

Common Name

English

SCILLIPHEOSIDE

Common Name

English

BUFA-4,20,22-TRIENOLIDE, 3-((6-DEOXY-.ALPHA.-L-MANNOPYRANOSYL)OXY)-12,14-DIHYDROXY-, (3.BETA.,12.BETA.)-

Systematic Name

English

Code System Code Type Description

CAS

21256-71-3

Created by admin on Sat Dec 16 08:25:17 GMT 2023 , Edited by admin on Sat Dec 16 08:25:17 GMT 2023

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EPA CompTox

DTXSID30943673

Created by admin on Sat Dec 16 08:25:17 GMT 2023 , Edited by admin on Sat Dec 16 08:25:17 GMT 2023

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FDA UNII

1RD23DNN41

Created by admin on Sat Dec 16 08:25:17 GMT 2023 , Edited by admin on Sat Dec 16 08:25:17 GMT 2023

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PUBCHEM

12315402

Created by admin on Sat Dec 16 08:25:17 GMT 2023 , Edited by admin on Sat Dec 16 08:25:17 GMT 2023

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