TRICHOTOMINE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C30H20N4O6
Molecular Weight	532.503
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC(=O)[C@@H]1CC2=C(NC3=CC=CC=C23)C4=C\C(C(=O)N14)=C5\C=C6N([C@@H](CC7=C6NC8=CC=CC=C78)C(O)=O)C5=O

InChI

InChIKey=LOHPAPKRMNSIDN-GKIAHDCUSA-N

InChI=1S/C30H20N4O6/c35-27-17(11-21-25-15(9-23(29(37)38)33(21)27)13-5-1-3-7-19(13)31-25)18-12-22-26-16(14-6-2-4-8-20(14)32-26)10-24(30(39)40)34(22)28(18)36/h1-8,11-12,23-24,31-32H,9-10H2,(H,37,38)(H,39,40)/b18-17+/t23-,24-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C30H20N4O6
Molecular Weight	532.503
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 17:04:05 GMT 2023` Edited by `admin` on `Sat Dec 16 17:04:05 GMT 2023`
Record UNII	52GDN97EHY
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

TRICHOTOMINE

Common Name

English

3H-INDOLIZINO(8,7-B)INDOLE-5-CARBOXYLIC ACID, 2-(5-CARBOXY-6,11-DIHYDRO-3-OXO-3H-INDOLIZINO(8,7-B)INDOL-2(5H)-YLIDENE)-2,5,6,11-TETRAHYDRO-3-OXO-, (S-(R*,R*-(E)))-

Systematic Name

English

3H-INDOLIZINO(8,7-B)INDOLE-5-CARBOXYLIC ACID, 2-((5S)-5-CARBOXY-6,11-DIHYDRO-3-OXO-3H-INDOLIZINO(8,7-B)INDOL-2(5H)-YLIDENE)-2,5,6,11-TETRAHYDRO-3-OXO-, (2E,5S)-

Systematic Name

English

(2E,5S)-2-((5S)-5-CARBOXY-6,11-DIHYDRO-3-OXO-3H-INDOLIZINO(8,7-B)INDOL-2(5H)-YLIDENE)-2,5,6,11-TETRAHYDRO-3-OXO-3H-INDOLIZINO(8,7-B)INDOLE-5-CARBOXYLIC ACID

Systematic Name

English

Code System Code Type Description

PUBCHEM

442120