EDOTECARIN

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C29H28N4O11
Molecular Weight	608.5528
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of EDOTECARIN

Structure Search

SMILES

OCC(CO)NN1C(=O)C2=C(C1=O)C3=C(N([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)C5=C3C=CC(O)=C5)C6=C2C7=C(N6)C=C(O)C=C7

InChI

InChIKey=QMVPQBFHUJZJCS-NTKFZFFISA-N

InChI=1S/C29H28N4O11/c34-7-10(8-35)31-33-27(42)20-18-13-3-1-11(37)5-15(13)30-22(18)23-19(21(20)28(33)43)14-4-2-12(38)6-16(14)32(23)29-26(41)25(40)24(39)17(9-36)44-29/h1-6,10,17,24-26,29-31,34-41H,7-9H2/t17-,24-,25+,26-,29-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C29H28N4O11
Molecular Weight	608.5528
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 `Sat Dec 16 15:57:28 UTC 2023` Edited by `admin` on `Sat Dec 16 15:57:28 UTC 2023`
Record UNII	1V8X590XDP
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

EDOTECARIN

Official Name

English

Edotecarin [WHO-DD]

Common Name

English

edotecarin [INN]

Common Name

English

PF-804950

Code

English

J-107088

Code

English

EDOTECARIN [USAN]

Common Name

English

EDOTECARIN [MI]

Common Name

English

12-.BETA.-D-GLUCOPYRANOSYL-2,10-DIHYDROXY-6-((1-HYDROXY-1-(HYDROXYMETHYL)ETHYL)AMINO)-12,13-DIHYDRO-6H-INDOLO(2,3-A)PYRROLO(3,4-C)CARBAZOLE-5,7-DIONE

Systematic Name

English

5H-INDOLO(2,3-A)PYRROLO(3,4-C)CARBAZOLE-5,7(6H)-DIONE, 12-.BETA.-D-GLUCOPYRANOSYL-12,13-DIHYDRO-2,10-DIHYDROXY-6-((2-HYDROXY-1-(HYDROXYMETHYL)ETHYL)AMINO)-

Systematic Name

English

Classification Tree Code System Code

NCI_THESAURUS

C1904

Created by admin on Sat Dec 16 15:57:28 UTC 2023 , Edited by admin on Sat Dec 16 15:57:28 UTC 2023

Code System Code Type Description

FDA UNII

1V8X590XDP

Created by admin on Sat Dec 16 15:57:28 UTC 2023 , Edited by admin on Sat Dec 16 15:57:28 UTC 2023

PRIMARY

ChEMBL

CHEMBL435191

Created by admin on Sat Dec 16 15:57:28 UTC 2023 , Edited by admin on Sat Dec 16 15:57:28 UTC 2023

PRIMARY

NCI_THESAURUS

C2665

Created by admin on Sat Dec 16 15:57:28 UTC 2023 , Edited by admin on Sat Dec 16 15:57:28 UTC 2023

PRIMARY

INN

8246

Created by admin on Sat Dec 16 15:57:28 UTC 2023 , Edited by admin on Sat Dec 16 15:57:28 UTC 2023

PRIMARY

SMS_ID

100000089430

Created by admin on Sat Dec 16 15:57:28 UTC 2023 , Edited by admin on Sat Dec 16 15:57:28 UTC 2023

PRIMARY

MERCK INDEX

m4830

Created by admin on Sat Dec 16 15:57:28 UTC 2023 , Edited by admin on Sat Dec 16 15:57:28 UTC 2023

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Merck Index

DRUG BANK

DB04882

Created by admin on Sat Dec 16 15:57:28 UTC 2023 , Edited by admin on Sat Dec 16 15:57:28 UTC 2023

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EPA CompTox

DTXSID40870123

Created by admin on Sat Dec 16 15:57:28 UTC 2023 , Edited by admin on Sat Dec 16 15:57:28 UTC 2023

PRIMARY

MESH

C121395

Created by admin on Sat Dec 16 15:57:28 UTC 2023 , Edited by admin on Sat Dec 16 15:57:28 UTC 2023

PRIMARY

CAS

174402-32-5

Created by admin on Sat Dec 16 15:57:28 UTC 2023 , Edited by admin on Sat Dec 16 15:57:28 UTC 2023

PRIMARY

PUBCHEM

9808998

Created by admin on Sat Dec 16 15:57:28 UTC 2023 , Edited by admin on Sat Dec 16 15:57:28 UTC 2023

PRIMARY

USAN

RR-32

Created by admin on Sat Dec 16 15:57:28 UTC 2023 , Edited by admin on Sat Dec 16 15:57:28 UTC 2023

PRIMARY

EVMPD

SUB25404

Created by admin on Sat Dec 16 15:57:28 UTC 2023 , Edited by admin on Sat Dec 16 15:57:28 UTC 2023

PRIMARY

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