TYROCIDINE C

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C70H89N15O13
Molecular Weight	1348.5484
Optical Activity	UNSPECIFIED
Defined Stereocenters	10 / 10
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(C)C[C@@H]1NC(=O)[C@H](CCCN)NC(=O)[C@@H](NC(=O)[C@H](CC2=CC=C(O)C=C2)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](CC3=CNC4=CC=CC=C34)NC(=O)[C@H](CC5=CNC6=CC=CC=C56)NC(=O)[C@@H]7CCCN7C(=O)[C@@H](CC8=CC=CC=C8)NC1=O)C(C)C

InChI

InChIKey=NJMWWUADORPGGY-AJOXBXEMSA-N

InChI=1S/C70H89N15O13/c1-38(2)30-51-63(91)83-56(32-40-14-6-5-7-15-40)70(98)85-29-13-21-57(85)68(96)82-54(34-43-37-75-48-19-11-9-17-46(43)48)65(93)80-53(33-42-36-74-47-18-10-8-16-45(42)47)64(92)81-55(35-59(73)88)66(94)76-50(26-27-58(72)87)62(90)79-52(31-41-22-24-44(86)25-23-41)67(95)84-60(39(3)4)69(97)77-49(20-12-28-71)61(89)78-51/h5-11,14-19,22-25,36-39,49-57,60,74-75,86H,12-13,20-21,26-35,71H2,1-4H3,(H2,72,87)(H2,73,88)(H,76,94)(H,77,97)(H,78,89)(H,79,90)(H,80,93)(H,81,92)(H,82,96)(H,83,91)(H,84,95)/t49-,50-,51-,52-,53+,54-,55-,56+,57-,60-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C70H89N15O13
Molecular Weight	1348.5484
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 08:15:52 GMT 2023` Edited by `admin` on `Sat Dec 16 08:15:52 GMT 2023`
Record UNII	FE5I9B0000
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

TYROCIDINE C

Common Name

English

TYROCIDINE A, 9-L-TRYPTOPHAN-10-D-TRYPTOPHAN-

Common Name

English

CYCLO(L-ASPARAGINYL-L-GLUTAMINYL-L-TYROSYL-L-VALYL-L-ORNITHYL-L-LEUCYL-D-PHENYLALANYL-L-PROLYL-L-TRYPTOPHYL-D-TRYPTOPHYL)

Common Name

English

TYROCIDINE C [MI]

Common Name

English

Code System Code Type Description

CAS

3252-29-7