VERRUCARIN B

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C27H32O9
Molecular Weight	500.5376
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]5O[C@]5(C)CCOC(=O)\C=C\C=CC(=O)O1)[C@]2(C)[C@]36CO6

InChI

InChIKey=WUZWNHCQLPXCLS-HBGYRMRFSA-N

InChI=1S/C27H32O9/c1-16-8-9-26-14-32-23(30)22-24(2,36-22)10-11-31-20(28)6-4-5-7-21(29)35-17-13-19(34-18(26)12-16)27(15-33-27)25(17,26)3/h4-7,12,17-19,22H,8-11,13-15H2,1-3H3/b6-4+,7-5-/t17-,18-,19-,22-,24-,25-,26-,27+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C27H32O9
Molecular Weight	500.5376
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 09:35:09 GMT 2023` Edited by `admin` on `Sat Dec 16 09:35:09 GMT 2023`
Record UNII	PHV68JZ445
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

VERRUCARIN B

Common Name

English

VERRUCARIN A, 2'-DEOXY-2',3'-EPOXY-, (2'S,3'R)-

Common Name

English

(2'S,3'R)-2'-DEOXY-2',3'-EPOXYVERRUCARIN A

Common Name

English

VERRUCARIN B [MI]

Common Name

English

Code System Code Type Description

MERCK INDEX

m11430