MARCFORTINE B

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C27H33N3O4
Molecular Weight	463.5686
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12C[C@]34CCCCN3C[C@@]1(C[C@@]5(C(=O)NC6=C7OC=CC(C)(C)OC7=CC=C56)C2(C)C)NC4=O

InChI

InChIKey=SGIZPBSMKAKPSO-QKHVDVHYSA-N

InChI=1S/C27H33N3O4/c1-23(2)10-12-33-20-17(34-23)8-7-16-19(20)28-22(32)27(16)14-25-15-30-11-6-5-9-26(30,21(31)29-25)13-18(25)24(27,3)4/h7-8,10,12,18H,5-6,9,11,13-15H2,1-4H3,(H,28,32)(H,29,31)/t18-,25+,26-,27+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C27H33N3O4
Molecular Weight	463.5686
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 12:26:02 GMT 2023` Edited by `admin` on `Sat Dec 16 12:26:02 GMT 2023`
Record UNII	UZ94B8NQ35
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

MARCFORTINE B

Common Name

English

MARCFORTINE A, 30-DEMETHYL-

Common Name

English

30-DEMETHYLMARCFORTINE A

Common Name

English

(-)-MARCFORTINE B

Common Name

English

SPIRO(4H,8H-(1,4)DIOXEPINO(2,3-G)INDOLE-8,2'(3'H)-(1H,4H-3A,9A)(IMINOMETHANO)CYCLOPENTA(B)QUINOLIZINE)-9,11'(10H)-DIONE, 6',7',8',9',10',10'A-HEXAHYDRO-1',1',4,4-TETRAMETHYL-, (2'R,3'AS,9'AS,10'AS)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

102091744

Created by admin on Sat Dec 16 12:26:02 GMT 2023 , Edited by admin on Sat Dec 16 12:26:02 GMT 2023

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EPA CompTox

DTXSID201017686

Created by admin on Sat Dec 16 12:26:02 GMT 2023 , Edited by admin on Sat Dec 16 12:26:02 GMT 2023

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CAS

75789-29-6

Created by admin on Sat Dec 16 12:26:02 GMT 2023 , Edited by admin on Sat Dec 16 12:26:02 GMT 2023

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FDA UNII

UZ94B8NQ35

Created by admin on Sat Dec 16 12:26:02 GMT 2023 , Edited by admin on Sat Dec 16 12:26:02 GMT 2023

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