SCUTELATERIN C

Details

Stereochemistry	MIXED
Molecular Formula	C29H44O10
Molecular Weight	552.6537
Optical Activity	UNSPECIFIED
Defined Stereocenters	10 / 12
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@]12CC(O)O[C@@]1([H])O[C@@H](C2)[C@@]3(C)[C@H](C)C[C@H](OC(C)=O)[C@]4(COC(C)=O)[C@]3([H])C[C@@H](C[C@]45CO5)OC(=O)C(C)CC

InChI

InChIKey=XLKOZUPYEXVJCF-VMQXANDJSA-N

InChI=1S/C29H44O10/c1-7-15(2)25(33)37-20-11-21-27(6,22-9-19-10-24(32)39-26(19)38-22)16(3)8-23(36-18(5)31)29(21,14-34-17(4)30)28(12-20)13-35-28/h15-16,19-24,26,32H,7-14H2,1-6H3/t15?,16-,19+,20+,21-,22+,23+,24?,26-,27+,28+,29+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C29H44O10
Molecular Weight	552.6537
Charge	0
Count

Stereochemistry	MIXED
Additional Stereochemistry	No
Defined Stereocenters	10 / 12
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:27:49 GMT 2023` Edited by `admin` on `Sat Dec 16 08:27:49 GMT 2023`
Record UNII	K3SQ9R4O30
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SCUTELATERIN C

Common Name

English

BUTANOIC ACID, 2-METHYL-, (1R,3S,4AR,5S,6R,8S,8AR)-8-(ACETYLOXY)-8A-((ACETYLOXY)METHYL)-5-((2S,3AS,6AR)-HEXAHYDRO-5-HYDROXYFURO(2,3-B)FURAN-2-YL)OCTAHYDRO-5,6-DIMETHYLSPIRO(NAPHTHALENE-1(2H),2'-OXIRAN)-3-YL ESTER

Systematic Name

English

Code System Code Type Description

PUBCHEM

86278290

Created by admin on Sat Dec 16 08:27:50 GMT 2023 , Edited by admin on Sat Dec 16 08:27:50 GMT 2023

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CAS

212069-17-5

Created by admin on Sat Dec 16 08:27:50 GMT 2023 , Edited by admin on Sat Dec 16 08:27:50 GMT 2023

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FDA UNII

K3SQ9R4O30

Created by admin on Sat Dec 16 08:27:50 GMT 2023 , Edited by admin on Sat Dec 16 08:27:50 GMT 2023

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