VERTISPORIN

Details

Stereochemistry	UNKNOWN
Molecular Formula	C29H36O10
Molecular Weight	544.5901
Optical Activity	UNSPECIFIED
Defined Stereocenters	10 / 10
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=C5/CCO[C@]6(CCC=CC(=O)O1)[C@@H](O)[C@H](O)O[C@]56[H])[C@]2(C)[C@]37CO7

InChI

InChIKey=LWUKARFJDWIVFQ-FVPSTRAOSA-N

InChI=1S/C29H36O10/c1-16-6-9-27-14-34-22(31)12-17-7-10-35-28(23(32)25(33)39-24(17)28)8-4-3-5-21(30)38-18-13-20(37-19(27)11-16)29(15-36-29)26(18,27)2/h3,5,11-12,18-20,23-25,32-33H,4,6-10,13-15H2,1-2H3/b5-3-,17-12+/t18-,19-,20-,23+,24-,25-,26-,27-,28-,29+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C29H36O10
Molecular Weight	544.5901
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 10:16:17 GMT 2023` Edited by `admin` on `Sat Dec 16 10:16:17 GMT 2023`
Record UNII	67OZU70MVI
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

VERTISPORIN

Common Name

English

SPIRO(4H-3A,22-(EPOXYETHANO)-10,12-METHANO-17H,18H-FURO(2',3':10,11)(1,6)DIOXACYCLOHEXADECINO(3,4-D)(1)BENZOPYRAN-11(12H),2'-OXIRANE)-8,20(5H,22AH)-DIONE, 2,3,10,10A,13A,16-HEXAHYDRO-2,3-DIHYDROXY-10A,15-DIMETHYL-, (2R,2'S,3R,3AR,6Z,10R,10AS,12R,13AR,17A

Systematic Name

English

Code System Code Type Description

PUBCHEM

121491489

Created by admin on Sat Dec 16 10:16:17 GMT 2023 , Edited by admin on Sat Dec 16 10:16:17 GMT 2023

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FDA UNII

67OZU70MVI

Created by admin on Sat Dec 16 10:16:17 GMT 2023 , Edited by admin on Sat Dec 16 10:16:17 GMT 2023

PRIMARY

CAS

57100-32-0

Created by admin on Sat Dec 16 10:16:17 GMT 2023 , Edited by admin on Sat Dec 16 10:16:17 GMT 2023

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