UNDULATINE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C18H21NO5
Molecular Weight	331.363
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CO[C@@H]1C[C@H]2[N@]3CC[C@]2([C@H]4O[C@@H]14)C5=C(C3)C(OC)=C6OCOC6=C5

InChI

InChIKey=XHXKHSUJQVCHTA-NWVCDLTISA-N

InChI=1S/C18H21NO5/c1-20-11-6-13-18(17-16(11)24-17)3-4-19(13)7-9-10(18)5-12-15(14(9)21-2)23-8-22-12/h5,11,13,16-17H,3-4,6-8H2,1-2H3/t11-,13-,16+,17+,18+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C18H21NO5
Molecular Weight	331.363
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	5 / 5
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 19:51:00 GMT 2025` Edited by `admin` on `Tue Apr 01 19:51:00 GMT 2025`
Record UNII	3FMI5M8S6J
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1.BETA.,2.BETA.-EPOXY-3.ALPHA.,7-DIMETHOXYCRINAN

Preferred Name

English

UNDULATINE

Common Name

English

2H,5H-4,10B-ETHANO(1,3)DIOXOLO(4,5-J)OXIRENO(A)PHENANTHRIDINE, 1A,3,3A,10C-TETRAHYDRO-2,6-DIMETHOXY-, (1AS-(1A.ALPHA.,2.ALPHA.,3A.ALPHA.,4.BETA.,10B.BETA.,10C.ALPHA.))-

Systematic Name

English

CRINAN, 1,2-EPOXY-3,7-DIMETHOXY-, (1BETA,2BETA,3ALPHA)-

Common Name

English

UNDULATIN

Common Name

English

2H,5H-4,10B-ETHANO(1,3)DIOXOLO(4,5-J)OXIRENO(A)PHENANTHRIDINE, 1A,3,3A,10C-TETRAHYDRO-2,6-DIMETHOXY-, (1AS,2R,3AR,4S,10BS,10CR)-

Systematic Name

English

(1AS,2R,3AR,4S,10BS,10CR)-1A,3,3A,10C-TETRAHYDRO-2,6-DIMETHOXY-2H,5H-4,10B-ETHANO(1,3)DIOXOLO(4,5-J)OXIRENO(A)PHENANTHRIDINE

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID80218924

Created by admin on Tue Apr 01 19:51:00 GMT 2025 , Edited by admin on Tue Apr 01 19:51:00 GMT 2025

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PUBCHEM

3083985

Created by admin on Tue Apr 01 19:51:00 GMT 2025 , Edited by admin on Tue Apr 01 19:51:00 GMT 2025

PRIMARY

CAS

6882-09-3

Created by admin on Tue Apr 01 19:51:00 GMT 2025 , Edited by admin on Tue Apr 01 19:51:00 GMT 2025

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FDA UNII

3FMI5M8S6J

Created by admin on Tue Apr 01 19:51:00 GMT 2025 , Edited by admin on Tue Apr 01 19:51:00 GMT 2025

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