7-Aminomethyl-10,11-methylenedioxycamptothecin

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C22H19N3O6
Molecular Weight	421.4028
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 7-Aminomethyl-10,11-methylenedioxycamptothecin

SMILES

CC[C@@]1(O)C(=O)OCC2=C1C=C3N(CC4=C(CN)C5=CC6=C(OCO6)C=C5N=C34)C2=O

InChI

InChIKey=QILNNZJGRYNYJV-QFIPXVFZSA-N

InChI=1S/C22H19N3O6/c1-2-22(28)14-4-16-19-12(7-25(16)20(26)13(14)8-29-21(22)27)11(6-23)10-3-17-18(31-9-30-17)5-15(10)24-19/h3-5,28H,2,6-9,23H2,1H3/t22-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C22H19N3O6
Molecular Weight	421.4028
Charge	0
Count	MOL RATIO 1 MOL RATIO (average)

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical
Record UNII	24U854P3Z8
Record Status	`Validated (UNII)`
Record Version

Show entries

Name

Type

Language

7-Aminomethyl-10,11-methylenedioxycamptothecin

Common Name

English

7-Aminomethyl-10,11-methylenedioxy CPT

Preferred Name

English

(S)-14-(aminomethyl)-7-ethyl-7-hydroxy-7h-[1,3]dioxolo[4,5-g]pyrano[3',4':6,7]indolizino[1,2-b]quinoline-8,11(10h,13h)-dione

Systematic Name

English

7-MAD-MDCPT

Common Name

English

(5S)-14-(aminomethyl)-5-ethyl-5-hydroxy-7,18,20-trioxa-11,24-diazahexacyclo[11.11.0.02,11.04,9.015,23.017,21]tetracosa-1(24),2,4(9),13,15,17(21),22-heptaene-6,10-dione

Systematic Name

English

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Code System

Code

Type

Description

PUBCHEM

139571883

PRIMARY