VERRUCARIN A, (4S)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C27H34O9
Molecular Weight	502.5535
Optical Activity	UNSPECIFIED
Defined Stereocenters	8 / 8
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12C[C@H]3O[C@]4([H])C=C(C)CC[C@]4(COC(=O)[C@@H](O)[C@H](C)CCOC(=O)\C=C\C=CC(=O)O1)[C@]2(C)[C@]35CO5

InChI

InChIKey=NLUGUZJQJYVUHS-PHHWCKOQSA-N

InChI=1S/C27H34O9/c1-16-8-10-26-14-33-24(31)23(30)17(2)9-11-32-21(28)6-4-5-7-22(29)36-18-13-20(35-19(26)12-16)27(15-34-27)25(18,26)3/h4-7,12,17-20,23,30H,8-11,13-15H2,1-3H3/b6-4+,7-5-/t17-,18+,19-,20-,23+,25-,26-,27+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C27H34O9
Molecular Weight	502.5535
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	8 / 8
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 14:07:21 GMT 2023` Edited by `admin` on `Sat Dec 16 14:07:21 GMT 2023`
Record UNII	G16SB5FEC0
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

VERRUCARIN A, (4S)-

Common Name

English

Code System Code Type Description

PUBCHEM

5352025

Created by admin on Sat Dec 16 14:07:21 GMT 2023 , Edited by admin on Sat Dec 16 14:07:21 GMT 2023

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FDA UNII

G16SB5FEC0

Created by admin on Sat Dec 16 14:07:21 GMT 2023 , Edited by admin on Sat Dec 16 14:07:21 GMT 2023

PRIMARY

CAS

123406-47-3

Created by admin on Sat Dec 16 14:07:21 GMT 2023 , Edited by admin on Sat Dec 16 14:07:21 GMT 2023

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