RHIZOXIN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C35H47NO9
Molecular Weight	625.749
Optical Activity	UNSPECIFIED
Defined Stereocenters	11 / 11
E/Z Centers	3
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@]12CC(=O)O[C@]([H])(C1)[C@H](C)\C=C\[C@H]3O[C@]3(C)[C@@H](O)C[C@]([H])(OC(=O)[C@@H]4O[C@H]4C2)[C@H](C)[C@@H](OC)C(\C)=C\C=C\C(C)=C\C5=COC(C)=N5

InChI

InChIKey=OWPCHSCAPHNHAV-QIPOKPRISA-N

InChI=1S/C35H47NO9/c1-19(13-25-18-41-23(5)36-25)9-8-10-21(3)32(40-7)22(4)27-17-29(37)35(6)30(45-35)12-11-20(2)26-14-24(16-31(38)42-26)15-28-33(43-28)34(39)44-27/h8-13,18,20,22,24,26-30,32-33,37H,14-17H2,1-7H3/b9-8+,12-11+,19-13+,21-10+/t20-,22+,24+,26-,27+,28+,29+,30-,32+,33-,35-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C35H47NO9
Molecular Weight	625.749
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	11 / 11
E/Z Centers	3
Optical Activity	UNSPECIFIED

Approval Year

Patents

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:53:18 GMT 2023` Edited by `admin` on `Fri Dec 15 15:53:18 GMT 2023`
Record UNII	C1V1Y784E4
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

RHIZOXIN

Common Name

English

NSC-332598

Code

English

FR-900216

Code

English

WF-1360

Code

English

(1S-(1R*,3R*,5S*,8R*(1R*,2S*,3E,5E,7E),10R*,11S*,13S*,14E,16S*,17S*))-10-HYDROXY-8-(2-METHOXY-1,3,7-TRIMETHYL-8-(2-METHYL-4-OXAZOLYL)-3,5,7-OCTATRIENYL)-11,16-DIMETHYL-4,7,12,18-TETRAOXATETRACYCLO(15.3.1.03,5.011,13)HENEICOS-14-ENE-6,19-DIONE

Systematic Name

English

4,7,12,18-TETRAOXATETRACYCLO(15.3.1.03,5.011,13)HENEICOS-14-ENE-6,19-DIONE, 10-HYDROXY-8-(2-METHOXY-1,3,7-TRIMETHYL-8-(2-METHYL-4-OXAZOLYL)-3,5,7-OCTATRIENYL)-11,16-DIMETHYL-, (1S-(1R*,3R*,5S*,8R*(1R*,2S*,3E,5E,7E),10R*,11S*,13S*,14E,16S*,17S*))-

Systematic Name

English

RHIZOXIN [MI]

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C67477