TUBERINE, (+)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C27H35NO6
Molecular Weight	469.5699
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(=O)OC(C)(C)[C@@H]1CC[C@](C)(O1)[C@H](O)COC2=CC=C(CCNC(=O)C3=CC=CC=C3)C=C2

InChI

InChIKey=GFABGVSRKCKLKA-DXBVXKBHSA-N

InChI=1S/C27H35NO6/c1-19(29)33-26(2,3)24-14-16-27(4,34-24)23(30)18-32-22-12-10-20(11-13-22)15-17-28-25(31)21-8-6-5-7-9-21/h5-13,23-24,30H,14-18H2,1-4H3,(H,28,31)/t23-,24+,27+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C27H35NO6
Molecular Weight	469.5699
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 18:30:39 GMT 2023` Edited by `admin` on `Sat Dec 16 18:30:39 GMT 2023`
Record UNII	Q538IIM0H9
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

TUBERINE, (+)-

Common Name

English

(+)-TUBERINE

Common Name

English

BENZAMIDE, N-(2-(4-((2R)-2-((2S,5S)-5-(1-(ACETYLOXY)-1-METHYLETHYL)TETRAHYDRO-2-METHYL-2-FURANYL)-2-HYDROXYETHOXY)PHENYL)ETHYL)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

9982128

Created by admin on Sat Dec 16 18:30:39 GMT 2023 , Edited by admin on Sat Dec 16 18:30:39 GMT 2023

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CAS

97400-75-4

Created by admin on Sat Dec 16 18:30:39 GMT 2023 , Edited by admin on Sat Dec 16 18:30:39 GMT 2023

PRIMARY

FDA UNII

Q538IIM0H9

Created by admin on Sat Dec 16 18:30:39 GMT 2023 , Edited by admin on Sat Dec 16 18:30:39 GMT 2023

PRIMARY

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TUBERINE, (-)-

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