LACTUCOPICRIN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C23H22O7
Molecular Weight	410.4166
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12[C@@H](O)CC(C)=C3C(=O)C=C(COC(=O)CC4=CC=C(O)C=C4)[C@]3([H])[C@@]1([H])OC(=O)C2=C

InChI

InChIKey=QCDLLIUTDGNCPO-AEMJNJESSA-N

InChI=1S/C23H22O7/c1-11-7-16(25)20-12(2)23(28)30-22(20)21-14(9-17(26)19(11)21)10-29-18(27)8-13-3-5-15(24)6-4-13/h3-6,9,16,20-22,24-25H,2,7-8,10H2,1H3/t16-,20+,21-,22-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C23H22O7
Molecular Weight	410.4166
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 16:59:24 GMT 2023` Edited by `admin` on `Sat Dec 16 16:59:24 GMT 2023`
Record UNII	SKG846KJ3G
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

LACTUCOPICRIN

Common Name

English

[(3aR,4S,9aS,9bR)-4-hydroxy-6-methyl-3-methylidene-2,7-dioxo-4,5,9a,9b-tetrahydro-3aH-azuleno[8,7-b]furan-9-yl]methyl2-(4-hydroxyphenyl)acetate

Systematic Name

English

Intybin

Common Name

English

Benzeneacetic acid, 4-hydroxy-, (2,3,3a,4,5,7,9a,9b-octahydro-4-hydroxy-6-methyl-3-methylene-2,7-dioxoazuleno[4,5-b]furan-9-yl)methyl ester, [3aR-(3aα,4α,9aα,9bβ)]-

Systematic Name

English

Code System Code Type Description

CAS

6466-74-6