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

C[C@@H]1O[C@@H](O[C@H]2CC[C@]3(C)[C@H]4C[C@@H](O)[C@]5(C)[C@H](CC[C@]5(O)[C@@H]4CCC3=C2)C6=COC(=O)C=C6)[C@H](O)[C@H](O)[C@H]1O

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 `Mon Mar 31 22:03:55 GMT 2025` Edited by `admin` on `Mon Mar 31 22:03:55 GMT 2025`
Record UNII	1RD23DNN41
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SCILLIPHAOSIDE

Preferred Name

English

SCILLIPHAEOSIDE

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 Mon Mar 31 22:03:55 GMT 2025 , Edited by admin on Mon Mar 31 22:03:55 GMT 2025

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EPA CompTox

DTXSID30943673

Created by admin on Mon Mar 31 22:03:55 GMT 2025 , Edited by admin on Mon Mar 31 22:03:55 GMT 2025

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FDA UNII

1RD23DNN41

Created by admin on Mon Mar 31 22:03:55 GMT 2025 , Edited by admin on Mon Mar 31 22:03:55 GMT 2025

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PUBCHEM

12315402

Created by admin on Mon Mar 31 22:03:55 GMT 2025 , Edited by admin on Mon Mar 31 22:03:55 GMT 2025

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