DEHYDROAUSTIN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C27H30O9
Molecular Weight	498.5217
Optical Activity	UNSPECIFIED
Defined Stereocenters	8 / 8
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C[C@@H]1OC(=O)[C@@]23C(=C)[C@@]4(C)OC(=O)[C@@]12O[C@@]5([C@H]4OC(C)=O)C(=C)[C@]6(CC[C@@]35C)C=CC(=O)OC6(C)C

InChI

InChIKey=UMCNDSVRNDMSEX-DVMWOTGCSA-N

InChI=1S/C27H30O9/c1-13-23(8)18(33-16(4)28)26-14(2)24(10-9-17(29)34-21(24,5)6)12-11-22(26,7)25(13)19(30)32-15(3)27(25,36-26)20(31)35-23/h9-10,15,18H,1-2,11-12H2,3-8H3/t15-,18-,22-,23+,24+,25+,26+,27-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C27H30O9
Molecular Weight	498.5217
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 12:52:41 GMT 2023` Edited by `admin` on `Sat Dec 16 12:52:41 GMT 2023`
Record UNII	VFK6EA69NQ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DEHYDROAUSTIN

Common Name

English

(3S,3'S,3AS,6R,7S,7AS,11AS,11BR)-7-(ACETYLOXY)-6,7,11,11A-TETRAHYDRO-2',2',3,6,11A-PENTAMETHYL-8,12-BIS(METHYLENE)SPIRO(1H,4H,8H-3A,7A-EPOXY-6,11B-METHANO-3H-FURO(3,4-E)(3)BENZOXOCIN-9(10H),3'(6'H)-(2H)PYRAN)-1,4,6'-TRIONE

Systematic Name

English

AUSTIN, 19,34-DIDEHYDRO-12-DEOXY-12,18-EPOXY-18,19-DIHYDRO-, (18.BETA.)-

Systematic Name

English

SPIRO(1H,4H,8H-3A,7A-EPOXY-6,11B-METHANO-3H-FURO(3,4-E)(3)BENZOXOCIN-9(10H),3'(6'H)-(2H)PYRAN)-1,4,6'-TRIONE, 7-(ACETYLOXY)-6,7,11,11A-TETRAHYDRO-2',2',3,6,11A-PENTAMETHYL-8,12-BIS(METHYLENE)-, (3S,3'S,3AS,6R,7S,7AS,11AS,11BR)-

Systematic Name

English

Code System Code Type Description

FDA UNII

VFK6EA69NQ

Created by admin on Sat Dec 16 12:52:41 GMT 2023 , Edited by admin on Sat Dec 16 12:52:41 GMT 2023

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CAS

82893-35-4

Created by admin on Sat Dec 16 12:52:41 GMT 2023 , Edited by admin on Sat Dec 16 12:52:41 GMT 2023

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PUBCHEM

122201239

Created by admin on Sat Dec 16 12:52:41 GMT 2023 , Edited by admin on Sat Dec 16 12:52:41 GMT 2023

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