.GAMMA.-AMANITIN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C39H54N10O13S
Molecular Weight	902.97
Optical Activity	UNSPECIFIED
Defined Stereocenters	11 / 11
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@]1(NC(=O)CNC(=O)[C@@H]2CC3=C(NC4=C3C=CC(O)=C4)[S@+]([O-])C[C@H](NC(=O)CNC1=O)C(=O)N[C@@H](CC(N)=O)C(=O)N5C[C@H](O)C[C@H]5C(=O)N[C@@]([H])([C@@H](C)[C@H](C)O)C(=O)N2)[C@@H](C)CC

InChI

InChIKey=WVHGJJRMKGDTEC-WCIJHFMNSA-N

InChI=1S/C39H54N10O13S/c1-5-16(2)31-36(59)42-12-29(54)43-26-15-63(62)38-22(21-7-6-19(51)8-23(21)46-38)10-24(33(56)41-13-30(55)47-31)44-37(60)32(17(3)18(4)50)48-35(58)27-9-20(52)14-49(27)39(61)25(11-28(40)53)45-34(26)57/h6-8,16-18,20,24-27,31-32,46,50-52H,5,9-15H2,1-4H3,(H2,40,53)(H,41,56)(H,42,59)(H,43,54)(H,44,60)(H,45,57)(H,47,55)(H,48,58)/t16-,17-,18-,20+,24-,25-,26-,27-,31-,32-,63+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C39H54N10O13S
Molecular Weight	902.97
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	10 / 10
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:49:11 UTC 2023` Edited by `admin` on `Sat Dec 16 09:49:11 UTC 2023`
Record UNII	ZOZ8ILM7WM
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

.GAMMA.-AMANITIN

Common Name

English

CYCLO(L-ASPARAGINYL-4-HYDROXY-L-PROLYL-(S)-4-HYDROXY-L-ISOLEUCYL-6-HYDROXY-2-MERCAPTO-L-TRYPTOPHYLGLYCYL-L-ISOLEUCYLGLYCYL-L-CYSTEINYL) CYCLIC (4->8)-SULFIDE (R)-S-OXIDE

Common Name

English

AMANITIN, .GAMMA.-

Common Name

English

GAMMA-AMANITIN

Common Name

English

.ALPHA.-AMANITIN, 3-((4S)-4-HYDROXY-L-ISOLEUCINE)-

Common Name

English

Code System Code Type Description

HSDB

3460